SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5dxv'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
LEU A  45
PHE A  48
THR A  63
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
 0.98A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
LEU A  45
PHE A  48
THR A  63
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
CME  A 140 ( 4.5A)
 0.88A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
LEU A  45
THR A  63
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 (-4.2A)
NAP  A 201 (-3.7A)
None
None
 1.12A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
 0.96A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
CME  A 140 ( 4.5A)
 0.73A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
THR A  63
SER A  66
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
 1.08A 1ao8A-5dxvA:
13.1		 1ao8A-5dxvA:
26.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.40A 1cd2A-5dxvA:
12.2		 1cd2A-5dxvA:
24.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1D1G_A_MTXA171_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.48A 1d1gA-5dxvA:
13.5		 1d1gA-5dxvA:
30.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1D1G_B_MTXB171_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.48A 1d1gB-5dxvA:
13.4		 1d1gB-5dxvA:
30.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.89A 1ddrA-5dxvA:
16.5		 1ddrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
THR A  63
SER A  66
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
 0.76A 1ddrA-5dxvA:
16.5		 1ddrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.58A 1ddrA-5dxvA:
16.5		 1ddrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
 0.83A 1ddrA-5dxvA:
16.5		 1ddrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
SER A  66
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
 1.03A 1ddrA-5dxvA:
16.5		 1ddrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.08A 1ddrB-5dxvA:
16.8		 1ddrB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.47A 1ddrB-5dxvA:
16.8		 1ddrB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDR_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.67A 1ddrB-5dxvA:
16.8		 1ddrB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.96A 1ddsA-5dxvA:
16.7		 1ddsA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.56A 1ddsA-5dxvA:
16.7		 1ddsA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.75A 1ddsA-5dxvA:
16.7		 1ddsA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.79A 1ddsB-5dxvA:
17.0		 1ddsB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.51A 1ddsB-5dxvA:
17.0		 1ddsB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DDS_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.73A 1ddsB-5dxvA:
17.0		 1ddsB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DF7_A_MTXA501_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
ALA A   7
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
None
None
None
 0.40A 1df7A-5dxvA:
14.2		 1df7A-5dxvA:
30.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DG5_A_TOPA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
None
 0.54A 1dg5A-5dxvA:
14.2		 1dg5A-5dxvA:
30.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 1dhfA-5dxvA:
12.2		 1dhfA-5dxvA:
27.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.28A 1dhfB-5dxvA:
12.3		 1dhfB-5dxvA:
27.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.63A 1dhfB-5dxvA:
12.3		 1dhfB-5dxvA:
27.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.49A 1dhiA-5dxvA:
17.1		 1dhiA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.69A 1dhiA-5dxvA:
17.1		 1dhiA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.64A 1dhiA-5dxvA:
17.1		 1dhiA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.82A 1dhiA-5dxvA:
17.1		 1dhiA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.46A 1dhiB-5dxvA:
17.2		 1dhiB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHI_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.64A 1dhiB-5dxvA:
17.2		 1dhiB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.48A 1dhjA-5dxvA:
17.0		 1dhjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.66A 1dhjA-5dxvA:
17.0		 1dhjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.68A 1dhjA-5dxvA:
17.0		 1dhjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.84A 1dhjA-5dxvA:
17.0		 1dhjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
ILE A  67
LEU A  71
PRO A  72
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 1.01A 1dhjB-5dxvA:
17.1		 1dhjB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
PRO A  72
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
None
CME  A 140 ( 4.5A)
 0.53A 1dhjB-5dxvA:
17.1		 1dhjB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHJ_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
PRO A  72
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
None
CME  A 140 ( 4.5A)
 0.65A 1dhjB-5dxvA:
17.1		 1dhjB-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.95A 1dlsA-5dxvA:
12.5		 1dlsA-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.62A 1dlsA-5dxvA:
12.5		 1dlsA-5dxvA:
28.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.54A 1draA-5dxvA:
17.0		 1draA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.72A 1draA-5dxvA:
17.0		 1draA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.73A 1draA-5dxvA:
17.0		 1draA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.91A 1draA-5dxvA:
17.0		 1draA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.50A 1draB-5dxvA:
17.2		 1draB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRA_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.67A 1draB-5dxvA:
17.2		 1draB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.53A 1drbA-5dxvA:
17.0		 1drbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.71A 1drbA-5dxvA:
17.0		 1drbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.68A 1drbA-5dxvA:
17.0		 1drbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.85A 1drbA-5dxvA:
17.0		 1drbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.46A 1drbB-5dxvA:
17.2		 1drbB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRB_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.60A 1drbB-5dxvA:
17.2		 1drbB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRE_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
PHE A  48
SER A  66
ILE A  67
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
 0.91A 1dreA-5dxvA:
17.0		 1dreA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRE_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.50A 1dreA-5dxvA:
17.0		 1dreA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRE_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.91A 1dreA-5dxvA:
17.0		 1dreA-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DRF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
LEU A  71
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.54A 1drfA-5dxvA:
12.5		 1drfA-5dxvA:
27.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYI_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.46A 1dyiA-5dxvA:
17.1		 1dyiA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYI_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.69A 1dyiA-5dxvA:
17.1		 1dyiA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYI_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.35A 1dyiB-5dxvA:
17.3		 1dyiB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYI_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.43A 1dyiB-5dxvA:
17.3		 1dyiB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYI_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.70A 1dyiB-5dxvA:
17.3		 1dyiB-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DYR_A_TOPA407_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
PHE A  48
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.39A 1dyrA-5dxvA:
12.4		 1dyrA-5dxvA:
24.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J3J_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.68A 1j3jA-5dxvA:
7.5		 1j3jA-5dxvA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J3J_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.46A 1j3jA-5dxvA:
7.5		 1j3jA-5dxvA:
19.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J3J_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 9 ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.61A 1j3jB-5dxvA:
11.8		 1j3jB-5dxvA:
19.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOL_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
TRP A  47
PHE A  48
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
 1.10A 1jolA-5dxvA:
17.1		 1jolA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOL_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.40A 1jolA-5dxvA:
17.1		 1jolA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOL_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.73A 1jolA-5dxvA:
17.1		 1jolA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOL_B_FFOB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.42A 1jolB-5dxvA:
17.2		 1jolB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOL_B_FFOB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.70A 1jolB-5dxvA:
17.2		 1jolB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOM_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   6
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.13A 1jomA-5dxvA:
17.2		 1jomA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOM_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.38A 1jomA-5dxvA:
17.2		 1jomA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1JOM_A_FFOA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.66A 1jomA-5dxvA:
17.2		 1jomA-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_A_FOLA605_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.50A 1qzfA-5dxvA:
4.4		 1qzfA-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_A_FOLA605_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 1.04A 1qzfA-5dxvA:
4.4		 1qzfA-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_B_FOLB609_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 1qzfB-5dxvA:
3.6		 1qzfB-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_B_FOLB609_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 1.04A 1qzfB-5dxvA:
3.6		 1qzfB-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_C_FOLC613_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 1qzfC-5dxvA:
12.4		 1qzfC-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_C_FOLC613_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 1.04A 1qzfC-5dxvA:
12.4		 1qzfC-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_D_FOLD617_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 1qzfD-5dxvA:
4.4		 1qzfD-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_D_FOLD617_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 1.04A 1qzfD-5dxvA:
4.4		 1qzfD-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_E_FOLE621_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.53A 1qzfE-5dxvA:
3.7		 1qzfE-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QZF_E_FOLE621_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 1.04A 1qzfE-5dxvA:
3.7		 1qzfE-5dxvA:
13.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.34A 1ra2A-5dxvA:
17.6		 1ra2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.68A 1ra2A-5dxvA:
17.6		 1ra2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.45A 1ra3A-5dxvA:
17.4		 1ra3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.65A 1ra3A-5dxvA:
17.4		 1ra3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA8_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.38A 1ra8A-5dxvA:
17.6		 1ra8A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA8_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.35A 1ra8A-5dxvA:
17.6		 1ra8A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RA8_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 1ra8A-5dxvA:
17.6		 1ra8A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.37A 1rb2A-5dxvA:
17.3		 1rb2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.66A 1rb2A-5dxvA:
17.3		 1rb2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB2_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.32A 1rb2B-5dxvA:
17.5		 1rb2B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB2_B_FOLB161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.65A 1rb2B-5dxvA:
17.5		 1rb2B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.42A 1rb3A-5dxvA:
17.1		 1rb3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
LEU A  45
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.71A 1rb3A-5dxvA:
17.1		 1rb3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB3_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.91A 1rb3B-5dxvA:
17.4		 1rb3B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB3_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.39A 1rb3B-5dxvA:
17.4		 1rb3B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RB3_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.59A 1rb3B-5dxvA:
17.4		 1rb3B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RD7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.43A 1rd7A-5dxvA:
16.9		 1rd7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RD7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.44A 1rd7A-5dxvA:
16.9		 1rd7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RD7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.65A 1rd7A-5dxvA:
16.9		 1rd7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RD7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.48A 1rd7B-5dxvA:
16.9		 1rd7B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RD7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.70A 1rd7B-5dxvA:
16.9		 1rd7B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RE7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.42A 1re7A-5dxvA:
16.9		 1re7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RE7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 1re7A-5dxvA:
16.9		 1re7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RE7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
PRO A  72
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.46A 1re7B-5dxvA:
16.9		 1re7B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RE7_B_FOLB361_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.75A 1re7B-5dxvA:
16.9		 1re7B-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RG7_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
THR A  63
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.99A 1rg7A-5dxvA:
16.8		 1rg7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RG7_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.69A 1rg7A-5dxvA:
16.8		 1rg7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RG7_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
 1.01A 1rg7A-5dxvA:
16.8		 1rg7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RH3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.84A 1rh3A-5dxvA:
17.0		 1rh3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RH3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.48A 1rh3A-5dxvA:
17.0		 1rh3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.38A 1rx2A-5dxvA:
17.3		 1rx2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX2_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.62A 1rx2A-5dxvA:
17.3		 1rx2A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.98A 1rx3A-5dxvA:
17.1		 1rx3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.44A 1rx3A-5dxvA:
17.1		 1rx3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.66A 1rx3A-5dxvA:
17.1		 1rx3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.51A 1rx7A-5dxvA:
16.8		 1rx7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX7_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.70A 1rx7A-5dxvA:
16.8		 1rx7A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX8_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.44A 1rx8A-5dxvA:
17.1		 1rx8A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1RX8_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 1rx8A-5dxvA:
17.1		 1rx8A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TDR_A_MTXA170_1
(TELLUROMETHIONYL
DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.11A 1tdrA-5dxvA:
16.6		 1tdrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TDR_A_MTXA170_1
(TELLUROMETHIONYL
DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.56A 1tdrA-5dxvA:
16.6		 1tdrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TDR_A_MTXA170_1
(TELLUROMETHIONYL
DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.72A 1tdrA-5dxvA:
16.6		 1tdrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TDR_B_MTXB170_1
(TELLUROMETHIONYL
DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.58A 1tdrB-5dxvA:
16.5		 1tdrB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1TDR_B_MTXB170_1
(TELLUROMETHIONYL
DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.79A 1tdrB-5dxvA:
16.5		 1tdrB-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1U70_A_MTXA187_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
ALA A   7
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
None
None
None
 0.30A 1u70A-5dxvA:
12.5		 1u70A-5dxvA:
29.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1U72_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
SER A  66
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
 0.50A 1u72A-5dxvA:
12.5		 1u72A-5dxvA:
27.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.71A 2bl9A-5dxvA:
12.0		 2bl9A-5dxvA:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BLA_A_CP6A302_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
 0.84A 2blaA-5dxvA:
11.7		 2blaA-5dxvA:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BLA_A_CP6A302_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
ALA A   7
PHE A  48
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.39A 2blaA-5dxvA:
11.7		 2blaA-5dxvA:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BLA_A_CP6A302_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A 111
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.48A 2blaA-5dxvA:
11.7		 2blaA-5dxvA:
23.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
THR A  63
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.43A 2cd2A-5dxvA:
12.3		 2cd2A-5dxvA:
24.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D0K_A_FOLA1161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
ILE A  67
LEU A  71
PRO A  72
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 1.24A 2d0kA-5dxvA:
17.0		 2d0kA-5dxvA:
67.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D0K_A_FOLA1161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
PRO A  72
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
None
CME  A 140 ( 4.5A)
 0.58A 2d0kA-5dxvA:
17.0		 2d0kA-5dxvA:
67.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D0K_A_FOLA1161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
PRO A  72
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
None
CME  A 140 ( 4.5A)
 0.73A 2d0kA-5dxvA:
17.0		 2d0kA-5dxvA:
67.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D0K_B_FOLB2161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.49A 2d0kB-5dxvA:
16.8		 2d0kB-5dxvA:
67.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2D0K_B_FOLB2161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.74A 2d0kB-5dxvA:
16.8		 2d0kB-5dxvA:
67.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.50A 2drcA-5dxvA:
17.0		 2drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.69A 2drcA-5dxvA:
17.0		 2drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.73A 2drcA-5dxvA:
17.0		 2drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DRC_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.46A 2drcB-5dxvA:
17.1		 2drcB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2DRC_B_MTXB161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.68A 2drcB-5dxvA:
17.1		 2drcB-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.54A 2oipA-5dxvA:
3.4		 2oipA-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 1.02A 2oipA-5dxvA:
3.4		 2oipA-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.53A 2oipB-5dxvA:
3.5		 2oipB-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.94A 2oipB-5dxvA:
3.5		 2oipB-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.55A 2oipC-5dxvA:
12.7		 2oipC-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
THR A  63
LEU A  71
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 1.05A 2oipC-5dxvA:
12.7		 2oipC-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_D_MTXD617_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.62A 2oipD-5dxvA:
13.1		 2oipD-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_D_MTXD617_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.11A 2oipD-5dxvA:
13.1		 2oipD-5dxvA:
13.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_E_MTXE621_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.71A 2oipE-5dxvA:
4.0		 2oipE-5dxvA:
13.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QK8_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
ILE A  67
LEU A  71
PRO A  72
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.89A 2qk8A-5dxvA:
15.1		 2qk8A-5dxvA:
33.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QK8_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
PRO A  72
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.65A 2qk8A-5dxvA:
15.1		 2qk8A-5dxvA:
33.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2QK8_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
ILE A  67
LEU A  71
PRO A  72
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.91A 2qk8A-5dxvA:
15.1		 2qk8A-5dxvA:
33.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3A_A_TOPA1190_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.65A 2w3aA-5dxvA:
12.6		 2w3aA-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3A_B_TOPB1189_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.59A 2w3aB-5dxvA:
12.6		 2w3aB-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3A_B_TOPB1189_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
PHE A  48
THR A  63
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.48A 2w3aB-5dxvA:
12.6		 2w3aB-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3B_A_FOLA401_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.57A 2w3bA-5dxvA:
12.5		 2w3bA-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3B_B_FOLB401_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.63A 2w3bB-5dxvA:
12.5		 2w3bB-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3M_A_FOLA1188_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.69A 2w3mA-5dxvA:
12.5		 2w3mA-5dxvA:
28.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3M_B_FOLB1188_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.51A 2w3mB-5dxvA:
12.5		 2w3mB-5dxvA:
28.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3V_A_TOPA1169_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.33A 2w3vA-5dxvA:
15.5		 2w3vA-5dxvA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3V_A_TOPA1169_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
SER A  66
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.70A 2w3vA-5dxvA:
15.5		 2w3vA-5dxvA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3V_A_TOPA1169_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
PHE A  48
ILE A 111
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.87A 2w3vA-5dxvA:
15.5		 2w3vA-5dxvA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3V_A_TOPA1169_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
PHE A  48
SER A  66
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 1.11A 2w3vA-5dxvA:
15.5		 2w3vA-5dxvA:
30.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_A_TOPA1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
ALA A   7
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.66A 2w9sA-5dxvA:
14.2		 2w9sA-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_A_TOPA1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
LEU A  45
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.98A 2w9sA-5dxvA:
14.2		 2w9sA-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_B_TOPB1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
ALA A   7
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.65A 2w9sB-5dxvA:
14.2		 2w9sB-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_B_TOPB1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ILE A   5
LEU A  45
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.97A 2w9sB-5dxvA:
14.2		 2w9sB-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_C_TOPC1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 ILE A   5
ALA A   7
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.65A 2w9sC-5dxvA:
14.2		 2w9sC-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_D_TOPD1158_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ILE A   5
ALA A   7
SER A  66
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.40A 2w9sD-5dxvA:
13.9		 2w9sD-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_D_TOPD1158_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ILE A   5
LEU A  45
SER A  66
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.80A 2w9sD-5dxvA:
13.9		 2w9sD-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_E_TOPE1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 8 ILE A   5
ALA A   7
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
CME  A 140 ( 4.5A)
 0.37A 2w9sE-5dxvA:
13.8		 2w9sE-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_F_TOPF1159_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ILE A   5
ALA A   7
SER A  66
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.42A 2w9sF-5dxvA:
13.9		 2w9sF-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9S_F_TOPF1159_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ILE A   5
LEU A  45
SER A  66
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.83A 2w9sF-5dxvA:
13.9		 2w9sF-5dxvA:
31.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZZA_A_FOLA164_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.54A 2zzaA-5dxvA:
16.1		 2zzaA-5dxvA:
41.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZZA_A_FOLA164_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.89A 2zzaA-5dxvA:
16.1		 2zzaA-5dxvA:
41.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZZA_B_FOLB164_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.54A 2zzaB-5dxvA:
16.1		 2zzaB-5dxvA:
41.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2ZZA_B_FOLB164_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.91A 2zzaB-5dxvA:
16.1		 2zzaB-5dxvA:
41.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CD2_A_MTXA307_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
 0.35A 3cd2A-5dxvA:
12.3		 3cd2A-5dxvA:
24.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CL9_A_MTXA602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
SER A  66
PRO A  72
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
 1.21A 3cl9A-5dxvA:
11.7		 3cl9A-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CL9_A_MTXA602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
SER A  66
LEU A  71
PRO A  72
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.66A 3cl9A-5dxvA:
11.7		 3cl9A-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLB_A_TMQA611_1
(DHFR-TS)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ALA A   7
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.64A 3clbA-5dxvA:
9.2		 3clbA-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLB_B_TMQB612_1
(DHFR-TS)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
ILE A  67
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
 0.72A 3clbB-5dxvA:
9.1		 3clbB-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLB_B_TMQB612_1
(DHFR-TS)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
ILE A 111
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
 0.55A 3clbB-5dxvA:
9.1		 3clbB-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLB_C_TMQC613_1
(DHFR-TS)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 3clbC-5dxvA:
11.7		 3clbC-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CLB_D_TMQD614_1
(DHFR-TS)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
ILE A  67
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.61A 3clbD-5dxvA:
3.9		 3clbD-5dxvA:
15.28
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DAT_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.73A 3datA-5dxvA:
15.3		 3datA-5dxvA:
33.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DAT_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
 1.04A 3datA-5dxvA:
15.3		 3datA-5dxvA:
33.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DAU_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ALA A  46
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
EDO  A 203 (-3.6A)
PEG  A 202 ( 4.9A)
None
None
None
 0.59A 3dauA-5dxvA:
17.5		 3dauA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DAU_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ALA A  46
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
EDO  A 203 (-3.6A)
PEG  A 202 ( 4.9A)
None
None
None
 0.90A 3dauA-5dxvA:
17.5		 3dauA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.51A 3drcA-5dxvA:
17.0		 3drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.70A 3drcA-5dxvA:
17.0		 3drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.73A 3drcA-5dxvA:
17.0		 3drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
None
 0.90A 3drcA-5dxvA:
17.0		 3drcA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.45A 3drcB-5dxvA:
17.1		 3drcB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DRC_B_MTXB361_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.67A 3drcB-5dxvA:
17.1		 3drcB-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EIG_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
 0.62A 3eigA-5dxvA:
12.0		 3eigA-5dxvA:
27.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_B_TOPB200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
ILE A  67
LEU A  71
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.90A 3fl9B-5dxvA:
15.1		 3fl9B-5dxvA:
33.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_B_TOPB200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.91A 3fl9B-5dxvA:
15.1		 3fl9B-5dxvA:
33.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_G_TOPG200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
ILE A  67
LEU A  71
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.89A 3fl9G-5dxvA:
14.8		 3fl9G-5dxvA:
33.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HBB_A_TMQA611_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.63A 3hbbA-5dxvA:
11.6		 3hbbA-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HBB_B_TMQB612_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 9 ALA A   7
THR A  63
SER A  66
ILE A 111
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
 0.46A 3hbbB-5dxvA:
11.4		 3hbbB-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HBB_C_TMQC613_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 11 ALA A   7
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 3hbbC-5dxvA:
3.2		 3hbbC-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HBB_D_TMQD614_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
ILE A  67
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 3hbbD-5dxvA:
11.6		 3hbbD-5dxvA:
15.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.60A 3hj3A-5dxvA:
13.3		 3hj3A-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.99A 3hj3A-5dxvA:
13.3		 3hj3A-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.52A 3hj3B-5dxvA:
4.6		 3hj3B-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 1.01A 3hj3B-5dxvA:
4.6		 3hj3B-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.54A 3hj3C-5dxvA:
12.1		 3hj3C-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 LEU A  45
PHE A  48
THR A  63
LEU A  71
ARG A  74
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 1.00A 3hj3C-5dxvA:
12.1		 3hj3C-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_D_MTXD615_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.62A 3hj3D-5dxvA:
10.3		 3hj3D-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_D_MTXD615_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.73A 3hj3D-5dxvA:
10.3		 3hj3D-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_D_MTXD615_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.98A 3hj3D-5dxvA:
10.3		 3hj3D-5dxvA:
13.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_A_MTXA164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.94A 3ia4A-5dxvA:
16.3		 3ia4A-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_A_MTXA164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.73A 3ia4A-5dxvA:
16.3		 3ia4A-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_A_MTXA164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
 1.01A 3ia4A-5dxvA:
16.3		 3ia4A-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_A_MTXA164_2
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 4 ILE A   5
PHE A  48
ILE A 111
THR A 130
 None
PEG  A 202 ( 3.7A)
None
CME  A 140 ( 4.5A)
 0.20A 3ia4A-5dxvA:
16.3		 3ia4A-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_B_MTXB164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.95A 3ia4B-5dxvA:
16.2		 3ia4B-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_B_MTXB164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.72A 3ia4B-5dxvA:
16.2		 3ia4B-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_B_MTXB164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
LEU A  45
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
None
None
None
 0.93A 3ia4B-5dxvA:
16.2		 3ia4B-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_C_MTXC164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 1.17A 3ia4C-5dxvA:
16.3		 3ia4C-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_C_MTXC164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.67A 3ia4C-5dxvA:
16.3		 3ia4C-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_C_MTXC164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.88A 3ia4C-5dxvA:
16.3		 3ia4C-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_D_MTXD164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 1.16A 3ia4D-5dxvA:
16.2		 3ia4D-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_D_MTXD164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.65A 3ia4D-5dxvA:
16.2		 3ia4D-5dxvA:
42.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_D_MTXD164_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.85A 3ia4D-5dxvA:
16.2		 3ia4D-5dxvA:
42.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IX9_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
ALA A   7
LEU A  71
ARG A  74
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.62A 3ix9A-5dxvA:
14.3		 3ix9A-5dxvA:
27.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IX9_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
LEU A  45
LEU A  71
ARG A  74
THR A 130
 None
PEG  A 202 (-4.2A)
None
None
CME  A 140 ( 4.5A)
 0.99A 3ix9A-5dxvA:
14.3		 3ix9A-5dxvA:
27.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IX9_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
ALA A   7
LEU A  71
ARG A  74
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.57A 3ix9B-5dxvA:
14.4		 3ix9B-5dxvA:
27.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IX9_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
LEU A  45
LEU A  71
ARG A  74
THR A 130
 None
PEG  A 202 (-4.2A)
None
None
CME  A 140 ( 4.5A)
 0.98A 3ix9B-5dxvA:
14.4		 3ix9B-5dxvA:
27.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JW3_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
ILE A  67
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.47A 3jw3A-5dxvA:
15.4		 3jw3A-5dxvA:
34.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JW3_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 LEU A  45
ILE A  67
ILE A 111
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.95A 3jw3A-5dxvA:
15.4		 3jw3A-5dxvA:
34.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K2H_A_LYAA514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.10A 3k2hA-5dxvA:
13.1		 3k2hA-5dxvA:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K2H_A_LYAA514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.63A 3k2hA-5dxvA:
13.1		 3k2hA-5dxvA:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K2H_B_LYAB514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.78A 3k2hB-5dxvA:
4.7		 3k2hB-5dxvA:
14.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N0H_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 3n0hA-5dxvA:
12.5		 3n0hA-5dxvA:
27.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QFX_A_CP6A602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.30A 3qfxA-5dxvA:
11.8		 3qfxA-5dxvA:
26.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QFX_B_CP6B702_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   7
PHE A  48
THR A  63
SER A  66
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.29A 3qfxB-5dxvA:
11.8		 3qfxB-5dxvA:
26.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QG2_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
CME  A 140 ( 4.5A)
 0.63A 3qg2A-5dxvA:
12.0		 3qg2A-5dxvA:
11.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QG2_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.47A 3qg2A-5dxvA:
12.0		 3qg2A-5dxvA:
11.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QG2_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.66A 3qg2B-5dxvA:
11.8		 3qg2B-5dxvA:
11.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QGT_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.68A 3qgtA-5dxvA:
11.9		 3qgtA-5dxvA:
13.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QGT_B_CP6B609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.56A 3qgtB-5dxvA:
11.8		 3qgtB-5dxvA:
13.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QL0_A_FOLA160_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.24A 3ql0A-5dxvA:
17.4		 3ql0A-5dxvA:
68.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QL0_A_FOLA160_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.34A 3ql0A-5dxvA:
17.4		 3ql0A-5dxvA:
68.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QL0_A_FOLA160_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.61A 3ql0A-5dxvA:
17.4		 3ql0A-5dxvA:
68.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.41A 3ql3A-5dxvA:
17.4		 3ql3A-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3QL3_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.63A 3ql3A-5dxvA:
17.4		 3ql3A-5dxvA:
69.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3V_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.67A 3s3vA-5dxvA:
12.4		 3s3vA-5dxvA:
27.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQ8_A_TOPA2001_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 9 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A  67
ILE A 111
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.61A 3tq8A-5dxvA:
15.2		 3tq8A-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQ9_A_MTXA2001_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.84A 3tq9A-5dxvA:
15.5		 3tq9A-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQ9_A_MTXA2001_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.62A 3tq9A-5dxvA:
15.5		 3tq9A-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQ9_A_MTXA2001_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.73A 3tq9A-5dxvA:
15.5		 3tq9A-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQB_A_FOLA2001_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.01A 3tqbA-5dxvA:
15.4		 3tqbA-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQB_A_FOLA2001_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.62A 3tqbA-5dxvA:
15.4		 3tqbA-5dxvA:
37.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQB_A_FOLA2001_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 LEU A  45
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 PEG  A 202 (-4.2A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.82A 3tqbA-5dxvA:
15.4		 3tqbA-5dxvA:
37.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UM5_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
PHE A  48
THR A  63
SER A  66
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.43A 3um5A-5dxvA:
12.1		 3um5A-5dxvA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UM5_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 PHE A  48
THR A  63
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.70A 3um5A-5dxvA:
12.1		 3um5A-5dxvA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UM5_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 10 ILE A   5
PHE A  48
THR A  63
SER A  66
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.72A 3um5B-5dxvA:
11.8		 3um5B-5dxvA:
11.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_D_ZPCD1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 8 VAL A  89
MET A  59
ILE A  78
ASN A  76
 None
 0.79A 4a97C-5dxvA:
undetectable		 4a97C-5dxvA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_E_ZPCE1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 8 VAL A  89
MET A  59
ILE A  78
ASN A  76
 None
 0.78A 4a97D-5dxvA:
undetectable		 4a97D-5dxvA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_H_ZPCH1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 8 VAL A  89
MET A  59
ILE A  78
ASN A  76
 None
 0.81A 4a97G-5dxvA:
undetectable		 4a97G-5dxvA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A97_J_ZPCJ1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5dxv RETHREADED DHFR
(synthetic
construct) 		4 / 8 VAL A  89
MET A  59
ILE A  78
ASN A  76
 None
 0.77A 4a97I-5dxvA:
undetectable		 4a97I-5dxvA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CD2_A_FOLA207_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.51A 4cd2A-5dxvA:
12.5		 4cd2A-5dxvA:
24.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.93A 4dfrA-5dxvA:
16.8		 4dfrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
THR A  63
SER A  66
LEU A  71
ARG A  74
TYR A 117
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
 0.79A 4dfrA-5dxvA:
16.8		 4dfrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.57A 4dfrA-5dxvA:
16.8		 4dfrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
 0.82A 4dfrA-5dxvA:
16.8		 4dfrA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_B_MTXB162_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.49A 4dfrB-5dxvA:
17.0		 4dfrB-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DFR_B_MTXB162_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4dfrB-5dxvA:
17.0		 4dfrB-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ECK_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.62A 4eckA-5dxvA:
11.7		 4eckA-5dxvA:
11.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ECK_B_FOLB703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
PHE A  48
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.74A 4eckB-5dxvA:
11.6		 4eckB-5dxvA:
11.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.34A 4ej1A-5dxvA:
17.3		 4ej1A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.34A 4ej1A-5dxvA:
17.3		 4ej1A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.74A 4ej1A-5dxvA:
17.3		 4ej1A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.37A 4ej1B-5dxvA:
17.2		 4ej1B-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.44A 4ej1B-5dxvA:
17.2		 4ej1B-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJ1_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.83A 4ej1B-5dxvA:
17.2		 4ej1B-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FHB_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.17A 4fhbA-5dxvA:
17.4		 4fhbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FHB_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.41A 4fhbA-5dxvA:
17.4		 4fhbA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FHB_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.65A 4fhbA-5dxvA:
17.4		 4fhbA-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G8Z_X_TOPX301_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
PHE A  48
SER A  66
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.60A 4g8zX-5dxvA:
12.4		 4g8zX-5dxvA:
24.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4GH8_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.87A 4gh8A-5dxvA:
16.7		 4gh8A-5dxvA:
66.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4GH8_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.45A 4gh8A-5dxvA:
16.7		 4gh8A-5dxvA:
66.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4GH8_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
 0.76A 4gh8A-5dxvA:
16.7		 4gh8A-5dxvA:
66.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4GH8_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
ARG A  74
TYR A 117
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 0.50A 4gh8B-5dxvA:
16.6		 4gh8B-5dxvA:
66.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4GH8_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
LEU A  45
ILE A  67
ARG A  74
TYR A 117
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
 0.90A 4gh8B-5dxvA:
16.6		 4gh8B-5dxvA:
66.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I13_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.37A 4i13A-5dxvA:
17.3		 4i13A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I13_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.48A 4i13A-5dxvA:
17.3		 4i13A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I13_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.80A 4i13A-5dxvA:
17.3		 4i13A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I1N_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   6
TRP A  47
PHE A  48
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
None
None
 1.18A 4i1nA-5dxvA:
16.9		 4i1nA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I1N_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
TRP A  47
PHE A  48
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.41A 4i1nA-5dxvA:
16.9		 4i1nA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I1N_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
LEU A  45
TRP A  47
PHE A  48
LEU A  71
ARG A  74
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.59A 4i1nA-5dxvA:
16.9		 4i1nA-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KEB_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.64A 4kebB-5dxvA:
12.6		 4kebB-5dxvA:
27.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.66A 4kfjB-5dxvA:
12.6		 4kfjB-5dxvA:
27.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.41A 4kjjA-5dxvA:
16.3		 4kjjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
ALA A  46
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
EDO  A 203 (-3.6A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.40A 4kjjA-5dxvA:
16.3		 4kjjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJK_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.41A 4kjkA-5dxvA:
17.0		 4kjkA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJK_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.31A 4kjkA-5dxvA:
17.0		 4kjkA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJL_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.44A 4kjlA-5dxvA:
17.1		 4kjlA-5dxvA:
68.36
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJL_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		11 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
ARG A  69
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.77A 4kjlA-5dxvA:
17.1		 4kjlA-5dxvA:
68.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM0_A_CP6A201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 10 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.55A 4km0A-5dxvA:
13.8		 4km0A-5dxvA:
28.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM0_B_CP6B201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.49A 4km0B-5dxvA:
13.9		 4km0B-5dxvA:
28.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM2_A_TOPA202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.55A 4km2A-5dxvA:
14.0		 4km2A-5dxvA:
28.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
PHE A  48
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.47A 4km2B-5dxvA:
14.0		 4km2B-5dxvA:
28.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
PHE A  48
THR A  63
LEU A  71
ILE A 111
TYR A 117
 None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
None
None
 0.50A 4km2B-5dxvA:
14.0		 4km2B-5dxvA:
28.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_A_MTXA603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 4ky8A-5dxvA:
4.8		 4ky8A-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_A_MTXA603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 1.08A 4ky8A-5dxvA:
4.8		 4ky8A-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_B_MTXB603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.70A 4ky8B-5dxvA:
8.9		 4ky8B-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_B_MTXB603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
ARG A  74
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 1.04A 4ky8B-5dxvA:
8.9		 4ky8B-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_C_MTXC603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 4ky8C-5dxvA:
2.9		 4ky8C-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_C_MTXC603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
SER A  66
ILE A  67
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
CME  A 140 ( 4.5A)
 0.71A 4ky8C-5dxvA:
2.9		 4ky8C-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_D_MTXD603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.74A 4ky8D-5dxvA:
6.3		 4ky8D-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_E_MTXE603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.73A 4ky8E-5dxvA:
4.5		 4ky8E-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   7
THR A  63
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.39A 4kyaA-5dxvA:
4.3		 4kyaA-5dxvA:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   7
THR A  63
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.39A 4kyaE-5dxvA:
12.6		 4kyaE-5dxvA:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KYA_G_FOLG703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   7
THR A  63
LEU A  71
ARG A  74
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.41A 4kyaG-5dxvA:
4.3		 4kyaG-5dxvA:
13.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M2X_A_TMQA202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
ALA A   7
PHE A  48
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
None
None
None
 0.48A 4m2xA-5dxvA:
13.6		 4m2xA-5dxvA:
30.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M2X_C_TMQC202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ILE A   5
ALA A   7
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.50A 4m2xC-5dxvA:
13.7		 4m2xC-5dxvA:
30.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M2X_E_TMQE202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
ALA A   7
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
None
None
 0.51A 4m2xE-5dxvA:
8.2		 4m2xE-5dxvA:
30.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M2X_G_TMQG202_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ILE A   5
ALA A   7
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.34A 4m2xG-5dxvA:
13.7		 4m2xG-5dxvA:
30.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.54A 4m6kA-5dxvA:
12.6		 4m6kA-5dxvA:
28.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX6_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.40A 4nx6A-5dxvA:
17.4		 4nx6A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX6_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.29A 4nx6A-5dxvA:
17.4		 4nx6A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX6_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.71A 4nx6A-5dxvA:
17.4		 4nx6A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX7_A_FOLA202_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.42A 4nx7A-5dxvA:
17.3		 4nx7A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX7_A_FOLA202_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.34A 4nx7A-5dxvA:
17.3		 4nx7A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX7_A_FOLA202_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.71A 4nx7A-5dxvA:
17.3		 4nx7A-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
PRO A  72
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.48A 4p3qA-5dxvA:
17.4		 4p3qA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
PRO A  72
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
 0.40A 4p3qA-5dxvA:
17.4		 4p3qA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3R_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.42A 4p3rA-5dxvA:
17.2		 4p3rA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3R_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.33A 4p3rA-5dxvA:
17.2		 4p3rA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3R_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.72A 4p3rA-5dxvA:
17.2		 4p3rA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P66_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.39A 4p66A-5dxvA:
17.4		 4p66A-5dxvA:
67.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P66_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
LEU A  45
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.57A 4p66A-5dxvA:
17.4		 4p66A-5dxvA:
67.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P68_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
PHE A  48
SER A  66
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 ( 3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.54A 4p68A-5dxvA:
17.3		 4p68A-5dxvA:
67.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSS_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.42A 4pssA-5dxvA:
undetectable		 4pssA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSS_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
ALA A  46
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
 None
NAP  A 201 (-3.7A)
EDO  A 203 (-3.6A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
 0.44A 4pssA-5dxvA:
undetectable		 4pssA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSS_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
ALA A  46
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
 None
PEG  A 202 (-4.2A)
EDO  A 203 (-3.6A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.68A 4pssA-5dxvA:
undetectable		 4pssA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PST_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.41A 4pstA-5dxvA:
undetectable		 4pstA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PST_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.41A 4pstA-5dxvA:
undetectable		 4pstA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PST_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4pstA-5dxvA:
undetectable		 4pstA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSY_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
ALA A  46
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
EDO  A 203 (-3.6A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.47A 4psyA-5dxvA:
17.3		 4psyA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSY_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
ALA A  46
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
EDO  A 203 (-3.6A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.66A 4psyA-5dxvA:
17.3		 4psyA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTH_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.42A 4pthA-5dxvA:
17.1		 4pthA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTH_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.42A 4pthA-5dxvA:
17.1		 4pthA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
ARG A  74
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.45A 4ptjA-5dxvA:
17.3		 4ptjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.40A 4ptjA-5dxvA:
17.3		 4ptjA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.70A 4ptjA-5dxvA:
17.3		 4ptjA-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_A_MTXA604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 4q0dA-5dxvA:
13.1		 4q0dA-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_A_MTXA604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 1.09A 4q0dA-5dxvA:
13.1		 4q0dA-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_B_MTXB604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 4q0dB-5dxvA:
13.0		 4q0dB-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_B_MTXB604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 1.09A 4q0dB-5dxvA:
13.0		 4q0dB-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_C_MTXC604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.57A 4q0dC-5dxvA:
3.1		 4q0dC-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_C_MTXC604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
SER A  66
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.68A 4q0dC-5dxvA:
3.1		 4q0dC-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_D_MTXD604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.57A 4q0dD-5dxvA:
3.0		 4q0dD-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_D_MTXD604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   7
SER A  66
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.68A 4q0dD-5dxvA:
3.0		 4q0dD-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_E_MTXE604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 4q0dE-5dxvA:
13.0		 4q0dE-5dxvA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q0D_E_MTXE604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 LEU A  45
ILE A  67
LEU A  71
TYR A 117
THR A 130
 PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 1.09A 4q0dE-5dxvA:
13.0		 4q0dE-5dxvA:
13.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.50A 4qi9A-5dxvA:
16.5		 4qi9A-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.53A 4qi9A-5dxvA:
16.5		 4qi9A-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.91A 4qi9A-5dxvA:
16.5		 4qi9A-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.89A 4qi9A-5dxvA:
16.5		 4qi9A-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 4qi9B-5dxvA:
16.9		 4qi9B-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.62A 4qi9B-5dxvA:
16.9		 4qi9B-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.79A 4qi9B-5dxvA:
16.9		 4qi9B-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
SER A  66
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.86A 4qi9B-5dxvA:
16.9		 4qi9B-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_C_MTXC201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.52A 4qi9C-5dxvA:
17.7		 4qi9C-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QI9_C_MTXC201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
ALA A   7
SER A  66
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.60A 4qi9C-5dxvA:
17.7		 4qi9C-5dxvA:
53.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLE_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.36A 4qleA-5dxvA:
17.6		 4qleA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLE_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.71A 4qleA-5dxvA:
17.6		 4qleA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLE_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 1.00A 4qleB-5dxvA:
17.3		 4qleB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLE_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.59A 4qleB-5dxvA:
17.3		 4qleB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLE_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
LEU A  45
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.86A 4qleB-5dxvA:
17.3		 4qleB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLF_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 11 ALA A   6
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.09A 4qlfA-5dxvA:
17.7		 4qlfA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLF_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.31A 4qlfA-5dxvA:
17.7		 4qlfA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLF_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.68A 4qlfA-5dxvA:
17.7		 4qlfA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.13A 4qlgA-5dxvA:
17.6		 4qlgA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.42A 4qlgA-5dxvA:
17.6		 4qlgA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4qlgA-5dxvA:
17.6		 4qlgA-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.17A 4qlgB-5dxvA:
17.4		 4qlgB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.46A 4qlgB-5dxvA:
17.4		 4qlgB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4QLG_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.75A 4qlgB-5dxvA:
17.4		 4qlgB-5dxvA:
68.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RGC_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
PHE A  48
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.14A 4rgcA-5dxvA:
17.4		 4rgcA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RGC_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.41A 4rgcA-5dxvA:
17.4		 4rgcA-5dxvA:
69.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4RGC_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.66A 4rgcA-5dxvA:
17.4		 4rgcA-5dxvA:
69.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4X3U_B_SVRB102_1
(CHROMOBOX PROTEIN
HOMOLOG 7)		 5dxv RETHREADED DHFR
(synthetic
construct) 		3 / 3 LYS A 141
ARG A  12
VAL A  10
 CME  A 140 ( 3.3A)
None
None
 0.88A 4x3uA-5dxvA:
undetectable
4x3uB-5dxvA:
undetectable		 4x3uA-5dxvA:
18.59
4x3uB-5dxvA:
18.59
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.17A 4x5fA-5dxvA:
17.5		 4x5fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.40A 4x5fA-5dxvA:
17.5		 4x5fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4x5fA-5dxvA:
17.5		 4x5fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.18A 4x5fB-5dxvA:
17.5		 4x5fB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.41A 4x5fB-5dxvA:
17.5		 4x5fB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5F_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4x5fB-5dxvA:
17.5		 4x5fB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5G_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.38A 4x5gA-5dxvA:
17.5		 4x5gA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5G_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.72A 4x5gA-5dxvA:
17.5		 4x5gA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5G_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.97A 4x5gB-5dxvA:
17.4		 4x5gB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5G_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
THR A  63
ILE A  67
LEU A  71
ARG A  74
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
None
CME  A 140 ( 4.5A)
 0.44A 4x5gB-5dxvA:
17.4		 4x5gB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5G_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.70A 4x5gB-5dxvA:
17.4		 4x5gB-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5H_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.38A 4x5hA-5dxvA:
17.2		 4x5hA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5H_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.40A 4x5hA-5dxvA:
17.2		 4x5hA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5H_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.65A 4x5hA-5dxvA:
17.2		 4x5hA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5I_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.36A 4x5iA-5dxvA:
17.0		 4x5iA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5I_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.39A 4x5iA-5dxvA:
17.0		 4x5iA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5I_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.69A 4x5iA-5dxvA:
17.0		 4x5iA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.38A 4x5jA-5dxvA:
17.1		 4x5jA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4X5J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
THR A  63
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.75A 4x5jA-5dxvA:
17.1		 4x5jA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.51A 5e8qA-5dxvA:
17.1		 5e8qA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.78A 5e8qA-5dxvA:
17.1		 5e8qA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.30A 5e8qB-5dxvA:
5.4		 5e8qB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.42A 5e8qB-5dxvA:
5.4		 5e8qB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.78A 5e8qB-5dxvA:
5.4		 5e8qB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5EAJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.47A 5eajA-5dxvA:
17.1		 5eajA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5EAJ_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.76A 5eajA-5dxvA:
17.1		 5eajA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5EAJ_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
PRO A  72
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.47A 5eajB-5dxvA:
17.3		 5eajB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5EAJ_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.50A 5eajB-5dxvA:
17.3		 5eajB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5EAJ_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
PRO A  72
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.73A 5eajB-5dxvA:
17.3		 5eajB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 1.05A 5hi6A-5dxvA:
16.8		 5hi6A-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.62A 5hi6A-5dxvA:
16.8		 5hi6A-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.89A 5hi6A-5dxvA:
16.8		 5hi6A-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
SER A  66
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
 1.05A 5hi6B-5dxvA:
15.8		 5hi6B-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
SER A  66
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
NAP  A 201 ( 4.9A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.77A 5hi6B-5dxvA:
15.8		 5hi6B-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5HI6_B_MTXB201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 12 ILE A   5
LEU A  45
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.84A 5hi6B-5dxvA:
15.8		 5hi6B-5dxvA:
55.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 8 ILE A   5
ALA A   7
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
None
CME  A 140 ( 4.5A)
 0.35A 5uihA-5dxvA:
17.4		 5uihA-5dxvA:
73.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 8 ILE A   5
LEU A  45
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
None
None
CME  A 140 ( 4.5A)
 0.61A 5uihA-5dxvA:
17.4		 5uihA-5dxvA:
73.74
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UJX_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.46A 5ujxA-5dxvA:
17.2		 5ujxA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UJX_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.78A 5ujxA-5dxvA:
17.2		 5ujxA-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UJX_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 1.18A 5ujxB-5dxvA:
17.3		 5ujxB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UJX_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		9 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.49A 5ujxB-5dxvA:
17.3		 5ujxB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5UJX_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
ILE A  67
LEU A  71
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.75A 5ujxB-5dxvA:
17.3		 5ujxB-5dxvA:
69.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 12 ALA A   6
PHE A  48
THR A  63
ILE A  67
ARG A  74
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.23A 5z6fA-5dxvA:
17.3		 5z6fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
ALA A   7
PHE A  48
THR A  63
ILE A  67
ARG A  74
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.39A 5z6fA-5dxvA:
17.3		 5z6fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6F_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
PHE A  48
THR A  63
ILE A  67
ARG A  74
TYR A 117
THR A 130
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.69A 5z6fA-5dxvA:
17.3		 5z6fA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.41A 5z6jA-5dxvA:
17.2		 5z6jA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.38A 5z6jA-5dxvA:
17.2		 5z6jA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6J_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.67A 5z6jA-5dxvA:
17.2		 5z6jA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		6 / 12 ALA A   6
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
 NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
 1.42A 5z6kA-5dxvA:
17.1		 5z6kA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.38A 5z6kA-5dxvA:
17.1		 5z6kA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 12 ILE A   5
LEU A  45
TRP A  47
PHE A  48
ILE A  67
LEU A  71
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
PEG  A 202 ( 4.9A)
None
None
CME  A 140 ( 4.5A)
 0.68A 5z6kA-5dxvA:
17.1		 5z6kA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6L_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 9 ILE A   5
ALA A   7
ILE A  67
PRO A  72
ARG A  74
 None
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
 0.61A 5z6lA-5dxvA:
17.0		 5z6lA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6L_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 9 ILE A   5
LEU A  45
ILE A  67
PRO A  72
ARG A  74
 None
PEG  A 202 (-4.2A)
PEG  A 202 ( 4.9A)
None
None
 0.84A 5z6lA-5dxvA:
17.0		 5z6lA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6M_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		8 / 11 ILE A   5
ALA A   7
TRP A  47
PHE A  48
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
None
None
None
CME  A 140 ( 4.5A)
 0.44A 5z6mA-5dxvA:
16.9		 5z6mA-5dxvA:
67.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5Z6M_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		7 / 11 ILE A   5
LEU A  45
TRP A  47
PHE A  48
LEU A  71
ILE A 111
THR A 130
 None
PEG  A 202 (-4.2A)
None
PEG  A 202 ( 3.7A)
None
None
CME  A 140 ( 4.5A)
 0.82A 5z6mA-5dxvA:
16.9		 5z6mA-5dxvA:
67.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AOG_A_CP6A704_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
PHE A  48
THR A  63
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
CME  A 140 ( 4.5A)
 0.37A 6aogA-5dxvA:
12.5		 6aogA-5dxvA:
29.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AOG_B_CP6B704_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		5 / 10 ALA A   7
PHE A  48
THR A  63
TYR A 117
THR A 130
 NAP  A 201 (-3.7A)
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
None
CME  A 140 ( 4.5A)
 0.38A 6aogB-5dxvA:
7.2		 6aogB-5dxvA:
29.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
7DFR_A_FOLA161_0
(DIHYDROFOLATE
REDUCTASE)		 5dxv RETHREADED DHFR
(synthetic
construct) 		10 / 12 ILE A   5
ALA A   7
TRP A  47
PHE A  48
THR A  63
ILE A  67
LEU A  71
ILE A 111
TYR A 117
THR A 130
 None
NAP  A 201 (-3.7A)
None
PEG  A 202 ( 3.7A)
NAP  A 201 (-3.7A)
PEG  A 202 ( 4.9A)
None
None
None
CME  A 140 ( 4.5A)
 0.35A 7dfrA-5dxvA:
17.1		 7dfrA-5dxvA:
69.66