SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3tq9'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
LEU A  29
PHE A  32
THR A  47
SER A  50
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
 0.60A 1ao8A-3tq9A:
21.8		 1ao8A-3tq9A:
32.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ASP A  28
LEU A  29
PHE A  32
THR A  47
SER A  50
ARG A  58
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-2.8A)
 0.82A 1ao8A-3tq9A:
21.8		 1ao8A-3tq9A:
32.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1AO8_A_MTXA170_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 LEU A  29
THR A  47
SER A  50
LEU A  55
ARG A  58
 MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.86A 1ao8A-3tq9A:
21.8		 1ao8A-3tq9A:
32.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1BZF_A_TMQA170_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
LEU A  29
THR A  47
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
 0.64A 1bzfA-3tq9A:
21.4		 1bzfA-3tq9A:
32.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1BZF_A_TMQA170_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
PHE A  32
THR A  47
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
 0.67A 1bzfA-3tq9A:
21.4		 1bzfA-3tq9A:
32.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
LYS A  33
THR A  47
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.57A 1cd2A-3tq9A:
20.2		 1cd2A-3tq9A:
32.21
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.
1D1G_A_MTXA171_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.32A 1d1gA-3tq9A:
20.1		 1d1gA-3tq9A:
29.03
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.
1D1G_B_MTXB171_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.27A 1d1gB-3tq9A:
20.2		 1d1gB-3tq9A:
29.03
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.00A 1ddrA-3tq9A:
23.4		 1ddrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.69A 1ddrA-3tq9A:
23.4		 1ddrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
SER A  50
ILE A  51
LEU A  55
 None
None
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.31A 1ddrA-3tq9A:
23.4		 1ddrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.94A 1ddrB-3tq9A:
23.7		 1ddrB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.33A 1ddrB-3tq9A:
23.7		 1ddrB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
 0.62A 1ddrB-3tq9A:
23.7		 1ddrB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.88A 1ddsA-3tq9A:
23.8		 1ddsA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.49A 1ddsA-3tq9A:
23.8		 1ddsA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.00A 1ddsB-3tq9A:
24.3		 1ddsB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.47A 1ddsB-3tq9A:
24.3		 1ddsB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.25A 1df7A-3tq9A:
23.1		 1df7A-3tq9A:
36.41
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
 0.47A 1dg5A-3tq9A:
22.9		 1dg5A-3tq9A:
36.41
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.
1DHF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.58A 1dhfA-3tq9A:
21.2		 1dhfA-3tq9A:
29.50
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.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.52A 1dhfB-3tq9A:
21.5		 1dhfB-3tq9A:
29.50
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.98A 1dhiA-3tq9A:
23.7		 1dhiA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 1dhiA-3tq9A:
23.7		 1dhiA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.46A 1dhiA-3tq9A:
23.7		 1dhiA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 11 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.35A 1dhiB-3tq9A:
24.4		 1dhiB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.99A 1dhjA-3tq9A:
23.8		 1dhjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 1dhjA-3tq9A:
23.8		 1dhjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.48A 1dhjA-3tq9A:
23.8		 1dhjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
ILE A  51
LEU A  55
PRO A  56
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
 1.00A 1dhjB-3tq9A:
24.4		 1dhjB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
PRO A  56
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.39A 1dhjB-3tq9A:
24.4		 1dhjB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
PRO A  56
ARG A  58
ILE A  96
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 1.32A 1dhjB-3tq9A:
24.4		 1dhjB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.65A 1dlsA-3tq9A:
21.6		 1dlsA-3tq9A:
29.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.99A 1draA-3tq9A:
23.9		 1draA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.47A 1draA-3tq9A:
23.9		 1draA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.47A 1draA-3tq9A:
23.9		 1draA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.31A 1draB-3tq9A:
24.5		 1draB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 1drbA-3tq9A:
23.9		 1drbA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.46A 1drbA-3tq9A:
23.9		 1drbA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.95A 1drbB-3tq9A:
24.4		 1drbB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.36A 1drbB-3tq9A:
24.4		 1drbB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.38A 1drbB-3tq9A:
24.4		 1drbB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
SER A  50
ILE A  51
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
 0.97A 1dreA-3tq9A:
25.2		 1dreA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.56A 1dreA-3tq9A:
25.2		 1dreA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
SER A  50
ILE A  51
LEU A  55
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 0.75A 1drfA-3tq9A:
21.3		 1drfA-3tq9A:
29.50
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.01A 1dyiA-3tq9A:
24.1		 1dyiA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.46A 1dyiA-3tq9A:
24.1		 1dyiA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.08A 1dyiB-3tq9A:
24.4		 1dyiB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.45A 1dyiB-3tq9A:
24.4		 1dyiB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.07A 1dyiB-3tq9A:
24.4		 1dyiB-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DYR_A_TOPA407_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ILE A   6
ALA A   8
LEU A  21
PHE A  32
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.36A 1dyrA-3tq9A:
19.9		 1dyrA-3tq9A:
32.21
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.63A 1j3jA-3tq9A:
20.4		 1j3jA-3tq9A:
24.73
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 9 ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.63A 1j3jB-3tq9A:
20.1		 1j3jB-3tq9A:
24.73
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.41A 1jolA-3tq9A:
24.0		 1jolA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
PRO A  56
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-4.3A)
 0.32A 1jolB-3tq9A:
24.5		 1jolB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
PRO A  56
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.14A 1jolB-3tq9A:
24.5		 1jolB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 11 ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.42A 1jomA-3tq9A:
23.4		 1jomA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.60A 1qzfA-3tq9A:
12.1		 1qzfA-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.60A 1qzfB-3tq9A:
20.9		 1qzfB-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.61A 1qzfC-3tq9A:
12.7		 1qzfC-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.61A 1qzfD-3tq9A:
12.1		 1qzfD-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.61A 1qzfE-3tq9A:
12.1		 1qzfE-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.38A 1ra2A-3tq9A:
24.5		 1ra2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.65A 1ra2A-3tq9A:
24.5		 1ra2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.28A 1ra3A-3tq9A:
24.6		 1ra3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.53A 1ra3A-3tq9A:
24.6		 1ra3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.34A 1ra8A-3tq9A:
24.4		 1ra8A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.48A 1rb2A-3tq9A:
24.5		 1rb2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.50A 1rb2A-3tq9A:
24.5		 1rb2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.42A 1rb2B-3tq9A:
24.5		 1rb2B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.79A 1rb2B-3tq9A:
24.5		 1rb2B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 10 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.31A 1rb3A-3tq9A:
24.5		 1rb3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		11 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.65A 1rb3B-3tq9A:
24.6		 1rb3B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.37A 1rd7A-3tq9A:
23.8		 1rd7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.26A 1rd7A-3tq9A:
23.8		 1rd7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.43A 1rd7A-3tq9A:
23.8		 1rd7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.54A 1rd7B-3tq9A:
23.7		 1rd7B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.32A 1rd7B-3tq9A:
23.7		 1rd7B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.56A 1re7A-3tq9A:
23.9		 1re7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		11 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
PRO A  56
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 1re7B-3tq9A:
23.8		 1re7B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
PRO A  56
ILE A  96
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 ( 4.2A)
 1.27A 1re7B-3tq9A:
23.8		 1re7B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.94A 1rg7A-3tq9A:
23.3		 1rg7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
ASP A  28
LEU A  29
LYS A  33
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.20A 1rg7A-3tq9A:
23.3		 1rg7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
ASP A  28
LEU A  29
LYS A  33
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.60A 1rg7A-3tq9A:
23.3		 1rg7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ASP A  28
LEU A  29
PHE A  32
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.51A 1rh3A-3tq9A:
25.2		 1rh3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
ARG A  58
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.17A 1rh3A-3tq9A:
25.2		 1rh3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.52A 1rx2A-3tq9A:
26.0		 1rx2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.33A 1rx2A-3tq9A:
26.0		 1rx2A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.98A 1rx3A-3tq9A:
25.8		 1rx3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.42A 1rx3A-3tq9A:
25.8		 1rx3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.68A 1rx7A-3tq9A:
23.4		 1rx7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.44A 1rx7A-3tq9A:
23.4		 1rx7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
PRO A  56
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
 0.70A 1rx8A-3tq9A:
25.3		 1rx8A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
ILE A  51
LEU A  55
PRO A  56
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-4.3A)
 0.41A 1rx8A-3tq9A:
25.3		 1rx8A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.94A 1tdrA-3tq9A:
24.0		 1tdrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.44A 1tdrA-3tq9A:
24.0		 1tdrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.41A 1tdrB-3tq9A:
24.4		 1tdrB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
LEU A  21
SER A  50
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.71A 1u72A-3tq9A:
21.5		 1u72A-3tq9A:
29.50
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  21
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.64A 2bl9A-3tq9A:
20.4		 2bl9A-3tq9A:
26.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.57A 2blaA-3tq9A:
20.0		 2blaA-3tq9A:
25.91
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.
2BLA_A_CP6A302_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ILE A   6
ASP A  28
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.75A 2blaA-3tq9A:
20.0		 2blaA-3tq9A:
25.91
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
THR A  47
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.47A 2cd2A-3tq9A:
20.4		 2cd2A-3tq9A:
32.21
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
ILE A  51
LEU A  55
PRO A  56
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.61A 2d0kA-3tq9A:
23.4		 2d0kA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 1.24A 2d0kA-3tq9A:
23.4		 2d0kA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.45A 2d0kB-3tq9A:
23.5		 2d0kB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.98A 2drcA-3tq9A:
24.1		 2drcA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.46A 2drcA-3tq9A:
24.1		 2drcA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.47A 2drcA-3tq9A:
24.1		 2drcA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.29A 2drcB-3tq9A:
24.4		 2drcB-3tq9A:
43.37
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.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 PHE A 127
TYR A 126
ALA A   7
PRO A 128
GLY A  97
 None
None
NDP  A1001 ( 4.1A)
None
NDP  A1001 ( 3.8A)
 1.21A 2igtC-3tq9A:
undetectable		 2igtC-3tq9A:
18.29
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.
2J9D_A_ACTA1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ILE A   6
LYS A  39
GLU A  92
ILE A  94
ILE A  35
 MTX  A2001 (-4.0A)
None
None
None
None
 1.41A 2j9dA-3tq9A:
undetectable
2j9dB-3tq9A:
undetectable
2j9dC-3tq9A:
undetectable		 2j9dA-3tq9A:
20.79
2j9dB-3tq9A:
20.79
2j9dC-3tq9A:
20.79
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.
2J9D_A_ACTA1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ILE A  35
ILE A   6
LYS A  39
GLU A  92
ILE A  94
 None
MTX  A2001 (-4.0A)
None
None
None
 1.50A 2j9dA-3tq9A:
undetectable
2j9dB-3tq9A:
undetectable
2j9dC-3tq9A:
undetectable		 2j9dA-3tq9A:
20.79
2j9dB-3tq9A:
20.79
2j9dC-3tq9A:
20.79
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.
2J9D_A_ACTA1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 LYS A  39
GLU A  92
ILE A  94
ILE A  35
ILE A   6
 None
None
None
None
MTX  A2001 (-4.0A)
 1.39A 2j9dA-3tq9A:
undetectable
2j9dB-3tq9A:
undetectable
2j9dC-3tq9A:
undetectable		 2j9dA-3tq9A:
20.79
2j9dB-3tq9A:
20.79
2j9dC-3tq9A:
20.79
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.
2J9D_E_ACTE1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ILE A   6
LYS A  39
GLU A  92
ILE A  94
ILE A  35
 MTX  A2001 (-4.0A)
None
None
None
None
 1.39A 2j9dD-3tq9A:
undetectable
2j9dE-3tq9A:
undetectable
2j9dF-3tq9A:
undetectable		 2j9dD-3tq9A:
20.79
2j9dE-3tq9A:
20.79
2j9dF-3tq9A:
20.79
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.
2J9D_E_ACTE1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ILE A  35
ILE A   6
LYS A  39
GLU A  92
ILE A  94
 None
MTX  A2001 (-4.0A)
None
None
None
 1.45A 2j9dD-3tq9A:
undetectable
2j9dE-3tq9A:
undetectable
2j9dF-3tq9A:
undetectable		 2j9dD-3tq9A:
20.79
2j9dE-3tq9A:
20.79
2j9dF-3tq9A:
20.79
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.
2J9D_E_ACTE1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 LYS A  39
GLU A  92
ILE A  94
ILE A  35
ILE A   6
 None
None
None
None
MTX  A2001 (-4.0A)
 1.46A 2j9dD-3tq9A:
undetectable
2j9dE-3tq9A:
undetectable
2j9dF-3tq9A:
undetectable		 2j9dD-3tq9A:
20.79
2j9dE-3tq9A:
20.79
2j9dF-3tq9A:
20.79
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.
2J9D_H_ACTH1113_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ILE A   6
LYS A  39
GLU A  92
ILE A  94
ILE A  35
 MTX  A2001 (-4.0A)
None
None
None
None
 1.43A 2j9dG-3tq9A:
undetectable
2j9dH-3tq9A:
undetectable
2j9dI-3tq9A:
undetectable		 2j9dG-3tq9A:
20.79
2j9dH-3tq9A:
20.79
2j9dI-3tq9A:
20.79
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.
2J9D_H_ACTH1113_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ILE A  35
ILE A   6
LYS A  39
GLU A  92
ILE A  94
 None
MTX  A2001 (-4.0A)
None
None
None
 1.43A 2j9dG-3tq9A:
undetectable
2j9dH-3tq9A:
undetectable
2j9dI-3tq9A:
undetectable		 2j9dG-3tq9A:
20.79
2j9dH-3tq9A:
20.79
2j9dI-3tq9A:
20.79
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.
2J9D_H_ACTH1113_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 LYS A  39
GLU A  92
ILE A  94
ILE A  35
ILE A   6
 None
None
None
None
MTX  A2001 (-4.0A)
 1.39A 2j9dG-3tq9A:
undetectable
2j9dH-3tq9A:
undetectable
2j9dI-3tq9A:
undetectable		 2j9dG-3tq9A:
20.79
2j9dH-3tq9A:
20.79
2j9dI-3tq9A:
20.79
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.
2J9D_J_ACTJ1116_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 8 ILE A   6
LYS A  39
GLU A  92
ILE A  94
 MTX  A2001 (-4.0A)
None
None
None
 0.85A 2j9dJ-3tq9A:
undetectable
2j9dK-3tq9A:
undetectable
2j9dL-3tq9A:
undetectable		 2j9dJ-3tq9A:
20.79
2j9dK-3tq9A:
20.79
2j9dL-3tq9A:
20.79
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.
2OIP_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.63A 2oipA-3tq9A:
21.7		 2oipA-3tq9A:
18.76
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.
2OIP_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.56A 2oipB-3tq9A:
20.0		 2oipB-3tq9A:
18.76
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.
2OIP_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.59A 2oipC-3tq9A:
21.4		 2oipC-3tq9A:
18.76
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.
2OIP_D_MTXD617_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.70A 2oipD-3tq9A:
22.0		 2oipD-3tq9A:
18.76
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.
2OIP_E_MTXE621_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.68A 2oipE-3tq9A:
20.8		 2oipE-3tq9A:
18.76
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
ILE A  51
LEU A  55
PRO A  56
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
 0.89A 2qk8A-3tq9A:
25.4		 2qk8A-3tq9A:
38.76
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
PRO A  56
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
 0.64A 2qk8A-3tq9A:
25.4		 2qk8A-3tq9A:
38.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3A_A_TOPA1190_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.54A 2w3aA-3tq9A:
21.0		 2w3aA-3tq9A:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3A_B_TOPB1189_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.65A 2w3aB-3tq9A:
20.9		 2w3aB-3tq9A:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3B_A_FOLA401_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.50A 2w3bA-3tq9A:
21.1		 2w3bA-3tq9A:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3B_B_FOLB401_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.56A 2w3bB-3tq9A:
21.1		 2w3bB-3tq9A:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3M_A_FOLA1188_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.66A 2w3mA-3tq9A:
20.9		 2w3mA-3tq9A:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W3M_B_FOLB1188_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.49A 2w3mB-3tq9A:
21.0		 2w3mB-3tq9A:
30.35
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.
2W3V_A_TOPA1169_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
LEU A  29
PHE A  32
SER A  50
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.38A 2w3vA-3tq9A:
24.1		 2w3vA-3tq9A:
29.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9G_A_TOPA1159_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.53A 2w9gA-3tq9A:
25.3		 2w9gA-3tq9A:
38.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2W9H_A_TOPA1160_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.53A 2w9hA-3tq9A:
25.1		 2w9hA-3tq9A:
38.76
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 11 ILE A   6
ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.45A 2w9sA-3tq9A:
25.4		 2w9sA-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 11 ILE A   6
ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.46A 2w9sB-3tq9A:
25.4		 2w9sB-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ILE A   6
ALA A   8
LEU A  21
ASP A  28
SER A  50
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.44A 2w9sC-3tq9A:
25.4		 2w9sC-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ILE A   6
ALA A   8
ASP A  28
LEU A  29
SER A  50
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
 0.55A 2w9sD-3tq9A:
24.8		 2w9sD-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ILE A   6
ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
 0.62A 2w9sD-3tq9A:
24.8		 2w9sD-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 8 ILE A   6
ALA A   8
LEU A  21
ASP A  28
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
 0.54A 2w9sE-3tq9A:
24.9		 2w9sE-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ILE A   6
ALA A   8
ASP A  28
LEU A  29
SER A  50
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
 0.52A 2w9sF-3tq9A:
24.8		 2w9sF-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ILE A   6
ALA A   8
LEU A  21
ASP A  28
LEU A  29
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
 0.59A 2w9sF-3tq9A:
24.8		 2w9sF-3tq9A:
42.11
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.31A 2zzaA-3tq9A:
26.2		 2zzaA-3tq9A:
42.54
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 11 ILE A   6
ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.45A 2zzaB-3tq9A:
26.2		 2zzaB-3tq9A:
42.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3CD2_A_MTXA307_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
LEU A  21
LYS A  33
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.4A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.53A 3cd2A-3tq9A:
19.9		 3cd2A-3tq9A:
32.21
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))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
THR A  47
SER A  50
LEU A  55
PRO A  56
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-2.8A)
 0.52A 3cl9A-3tq9A:
19.1		 3cl9A-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.55A 3clbA-3tq9A:
19.7		 3clbA-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  51
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
 0.76A 3clbB-3tq9A:
18.6		 3clbB-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
 0.63A 3clbB-3tq9A:
18.6		 3clbB-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.54A 3clbC-3tq9A:
19.6		 3clbC-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.46A 3clbD-3tq9A:
19.4		 3clbD-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.54A 3datA-3tq9A:
25.7		 3datA-3tq9A:
38.76
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
ALA A  30
LYS A  33
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 ( 4.8A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.35A 3dauA-3tq9A:
25.5		 3dauA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
ARG A  58
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.09A 3dauA-3tq9A:
25.5		 3dauA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DFR_A_MTXA164_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.74A 3dfrA-3tq9A:
24.6		 3dfrA-3tq9A:
32.42
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.00A 3drcA-3tq9A:
24.0		 3drcA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.47A 3drcA-3tq9A:
24.0		 3drcA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
SER A  50
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.48A 3drcA-3tq9A:
24.0		 3drcA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.31A 3drcB-3tq9A:
24.5		 3drcB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
LEU A  21
SER A  50
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.77A 3eigA-3tq9A:
20.6		 3eigA-3tq9A:
29.50
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))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.61A 3fl9B-3tq9A:
24.2		 3fl9B-3tq9A:
38.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_C_TOPC200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   8
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.53A 3fl9C-3tq9A:
24.5		 3fl9C-3tq9A:
38.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_E_TOPE200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.64A 3fl9E-3tq9A:
24.3		 3fl9E-3tq9A:
38.20
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))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.60A 3fl9G-3tq9A:
24.1		 3fl9G-3tq9A:
38.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_H_TOPH200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ALA A   8
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.58A 3fl9H-3tq9A:
24.7		 3fl9H-3tq9A:
38.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FRB_X_TOPX300_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.53A 3frbX-3tq9A:
25.2		 3frbX-3tq9A:
38.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FRE_X_TOPX300_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 9 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.57A 3freX-3tq9A:
25.2		 3freX-3tq9A:
38.76
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.
3HBB_A_TMQA611_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.55A 3hbbA-3tq9A:
19.7		 3hbbA-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ALA A   8
ASP A  28
THR A  47
SER A  50
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
 0.76A 3hbbB-3tq9A:
18.7		 3hbbB-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.55A 3hbbC-3tq9A:
19.5		 3hbbC-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.47A 3hbbD-3tq9A:
19.6		 3hbbD-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.67A 3hj3A-3tq9A:
22.4		 3hj3A-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.61A 3hj3B-3tq9A:
22.4		 3hj3B-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.61A 3hj3C-3tq9A:
20.8		 3hj3C-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.71A 3hj3D-3tq9A:
8.7		 3hj3D-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.85A 3ia4A-3tq9A:
25.8		 3ia4A-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
SER A  50
ILE A  51
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
 0.56A 3ia4A-3tq9A:
25.8		 3ia4A-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.43A 3ia4A-3tq9A:
25.8		 3ia4A-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ILE A   6
PHE A  32
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.19A 3ia4A-3tq9A:
25.8		 3ia4A-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.85A 3ia4B-3tq9A:
26.1		 3ia4B-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.38A 3ia4B-3tq9A:
26.1		 3ia4B-3tq9A:
43.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IA4_B_MTXB164_2
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 PHE A  32
LYS A  33
ILE A  96
THR A 115
 MTX  A2001 (-4.3A)
None
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.22A 3ia4B-3tq9A:
26.1		 3ia4B-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.01A 3ia4C-3tq9A:
25.9		 3ia4C-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
LEU A  29
PHE A  32
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.31A 3ia4C-3tq9A:
25.9		 3ia4C-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.00A 3ia4D-3tq9A:
26.1		 3ia4D-3tq9A:
43.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.38A 3ia4D-3tq9A:
26.1		 3ia4D-3tq9A:
43.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IX9_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
LEU A  29
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.65A 3ix9A-3tq9A:
24.5		 3ix9A-3tq9A:
35.94
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IX9_B_MTXB200_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
LEU A  29
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.56A 3ix9B-3tq9A:
24.4		 3ix9B-3tq9A:
35.94
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
LEU A  29
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.36A 3jw3A-3tq9A:
25.9		 3jw3A-3tq9A:
38.76
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.88A 3jw3A-3tq9A:
25.9		 3jw3A-3tq9A:
38.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JW3_B_TOPB208_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ALA A   8
LEU A  21
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.73A 3jw3B-3tq9A:
25.9		 3jw3B-3tq9A:
38.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JW5_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   8
LEU A  21
LEU A  29
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.27A 3jw5A-3tq9A:
25.7		 3jw5A-3tq9A:
38.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3JW5_B_TOPB208_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.47A 3jw5B-3tq9A:
25.7		 3jw5B-3tq9A:
38.76
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.
3K2H_A_LYAA514_1
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
ASP A  28
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.64A 3k2hA-3tq9A:
22.0		 3k2hA-3tq9A:
17.61
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
ASP A  28
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.80A 3k2hB-3tq9A:
21.1		 3k2hB-3tq9A:
17.61
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.68A 3n0hA-3tq9A:
21.2		 3n0hA-3tq9A:
29.50
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.
3NRR_A_D16A520_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
THR A  47
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.38A 3nrrA-3tq9A:
21.2		 3nrrA-3tq9A:
17.61
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.
3NRR_B_D16B520_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
HIS A  24
ASP A  28
THR A  47
ILE A  51
THR A 115
 MTX  A2001 ( 3.4A)
None
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.72A 3nrrB-3tq9A:
22.1		 3nrrB-3tq9A:
17.61
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 3qfxA-3tq9A:
19.7		 3qfxA-3tq9A:
27.35
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.
3QFX_B_CP6B702_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 3qfxB-3tq9A:
19.7		 3qfxB-3tq9A:
27.35
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.
3QG2_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.62A 3qg2A-3tq9A:
20.3		 3qg2A-3tq9A:
14.83
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.62A 3qg2B-3tq9A:
20.2		 3qg2B-3tq9A:
14.83
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.61A 3qgtA-3tq9A:
20.4		 3qgtA-3tq9A:
15.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ILE A   6
ALA A   8
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.60A 3qgtB-3tq9A:
20.1		 3qgtB-3tq9A:
15.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.00A 3ql0A-3tq9A:
26.0		 3ql0A-3tq9A:
43.71
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.31A 3ql0A-3tq9A:
26.0		 3ql0A-3tq9A:
43.71
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
ILE A  51
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.32A 3ql3A-3tq9A:
26.1		 3ql3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.56A 3ql3A-3tq9A:
26.1		 3ql3A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.73A 3s3vA-3tq9A:
21.1		 3s3vA-3tq9A:
30.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 9 ILE A   6
ALA A   8
LEU A  21
ASP A  28
PHE A  32
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.30A 3tq8A-3tq9A:
28.4		 3tq8A-3tq9A:
100.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   7
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.98A 3tqbA-3tq9A:
30.1		 3tqbA-3tq9A:
100.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		11 / 11 ALA A   8
LEU A  21
ASP A  28
LEU A  29
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.47A 3tqbA-3tq9A:
30.1		 3tqbA-3tq9A:
100.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ILE A   6
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.66A 3um5A-3tq9A:
20.4		 3um5A-3tq9A:
15.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 10 ILE A   6
ASP A  28
PHE A  32
THR A  47
SER A  50
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.71A 3um5B-3tq9A:
20.1		 3um5B-3tq9A:
15.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4CD2_A_FOLA207_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.75A 4cd2A-3tq9A:
19.0		 4cd2A-3tq9A:
32.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4CD2_A_FOLA207_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
PHE A  32
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.53A 4cd2A-3tq9A:
19.0		 4cd2A-3tq9A:
32.21
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.01A 4dfrA-3tq9A:
23.9		 4dfrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
THR A  47
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.52A 4dfrA-3tq9A:
23.9		 4dfrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
SER A  50
ILE A  51
LEU A  55
 None
None
NDP  A1001 (-3.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.29A 4dfrA-3tq9A:
23.9		 4dfrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.28A 4dfrB-3tq9A:
24.4		 4dfrB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   8
LEU A  21
PHE A  32
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.69A 4eckA-3tq9A:
19.3		 4eckA-3tq9A:
16.14
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ALA A   8
LEU A  21
ASP A  28
PHE A  32
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.82A 4eckB-3tq9A:
19.3		 4eckB-3tq9A:
16.14
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.
4EIL_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.38A 4eilA-3tq9A:
21.1		 4eilA-3tq9A:
17.06
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.
4EIL_B_FOLB703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.54A 4eilB-3tq9A:
21.5		 4eilB-3tq9A:
17.06
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.
4EIL_C_FOLC703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.38A 4eilC-3tq9A:
21.1		 4eilC-3tq9A:
17.06
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.
4EIL_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.40A 4eilE-3tq9A:
21.6		 4eilE-3tq9A:
17.06
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.
4EIL_F_FOLF703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.53A 4eilF-3tq9A:
20.7		 4eilF-3tq9A:
17.06
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.
4EIL_G_FOLG703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.38A 4eilG-3tq9A:
21.2		 4eilG-3tq9A:
17.06
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.43A 4ej1A-3tq9A:
23.6		 4ej1A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.31A 4ej1A-3tq9A:
23.6		 4ej1A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.42A 4ej1A-3tq9A:
23.6		 4ej1A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.06A 4ej1B-3tq9A:
23.7		 4ej1B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
 0.54A 4ej1B-3tq9A:
23.7		 4ej1B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.43A 4ej1B-3tq9A:
23.7		 4ej1B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.05A 4ej1B-3tq9A:
23.7		 4ej1B-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.08A 4fhbA-3tq9A:
24.6		 4fhbA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		11 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.35A 4fhbA-3tq9A:
24.6		 4fhbA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.39A 4fhbA-3tq9A:
24.6		 4fhbA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.32A 4fhbA-3tq9A:
24.6		 4fhbA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4G8Z_X_TOPX301_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ILE A   6
ALA A   8
LEU A  21
PHE A  32
SER A  50
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.40A 4g8zX-3tq9A:
20.4		 4g8zX-3tq9A:
30.58
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.10A 4gh8A-3tq9A:
25.3		 4gh8A-3tq9A:
41.67
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.53A 4gh8A-3tq9A:
25.3		 4gh8A-3tq9A:
41.67
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
 0.47A 4gh8B-3tq9A:
25.1		 4gh8B-3tq9A:
41.67
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.50A 4i13A-3tq9A:
23.7		 4i13A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.31A 4i13A-3tq9A:
23.7		 4i13A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.42A 4i13A-3tq9A:
23.7		 4i13A-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4I13_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ASP A  28
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.25A 4i13A-3tq9A:
23.7		 4i13A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 11 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.39A 4i1nA-3tq9A:
23.7		 4i1nA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.61A 4kebB-3tq9A:
21.1		 4kebB-3tq9A:
29.50
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.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.62A 4kfjB-3tq9A:
21.3		 4kfjB-3tq9A:
29.50
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A  30
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 ( 4.8A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.34A 4kjjA-3tq9A:
25.0		 4kjjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ALA A  30
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 ( 4.8A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.39A 4kjjA-3tq9A:
25.0		 4kjjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.38A 4kjjA-3tq9A:
25.0		 4kjjA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJJ_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ASP A  28
LEU A  29
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.29A 4kjjA-3tq9A:
25.0		 4kjjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.33A 4kjkA-3tq9A:
25.9		 4kjkA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.39A 4kjkA-3tq9A:
25.9		 4kjkA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KJK_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ASP A  28
LEU A  29
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.29A 4kjkA-3tq9A:
25.9		 4kjkA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.37A 4kjlA-3tq9A:
25.5		 4kjlA-3tq9A:
43.71
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.36A 4kjlA-3tq9A:
25.5		 4kjlA-3tq9A:
43.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM0_A_CP6A201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 10 ILE A   6
ALA A   8
ASP A  28
PHE A  32
THR A  47
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.55A 4km0A-3tq9A:
21.5		 4km0A-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM0_B_CP6B201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
ASP A  28
PHE A  32
THR A  47
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.51A 4km0B-3tq9A:
21.7		 4km0B-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM2_A_TOPA202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
ASP A  28
PHE A  32
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.55A 4km2A-3tq9A:
22.0		 4km2A-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM2_A_TOPA202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
PHE A  32
THR A  47
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.64A 4km2A-3tq9A:
22.0		 4km2A-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
ASP A  28
PHE A  32
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.32A 4km2B-3tq9A:
21.4		 4km2B-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ASP A  28
PHE A  32
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.43A 4km2B-3tq9A:
21.4		 4km2B-3tq9A:
33.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KM2_B_TOPB202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A   6
PHE A  32
THR A  47
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.49A 4km2B-3tq9A:
21.4		 4km2B-3tq9A:
33.00
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.72A 4ky8A-3tq9A:
8.7		 4ky8A-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.63A 4ky8B-3tq9A:
15.9		 4ky8B-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.75A 4ky8C-3tq9A:
22.2		 4ky8C-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.68A 4ky8D-3tq9A:
18.6		 4ky8D-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.64A 4ky8E-3tq9A:
22.2		 4ky8E-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.43A 4kyaA-3tq9A:
21.1		 4kyaA-3tq9A:
17.06
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_B_FOLB703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.57A 4kyaB-3tq9A:
21.4		 4kyaB-3tq9A:
17.06
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_C_FOLC703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.43A 4kyaC-3tq9A:
15.3		 4kyaC-3tq9A:
17.06
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_D_FOLD703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.58A 4kyaD-3tq9A:
13.8		 4kyaD-3tq9A:
17.06
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.42A 4kyaE-3tq9A:
21.1		 4kyaE-3tq9A:
17.06
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_F_FOLF703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.55A 4kyaF-3tq9A:
13.8		 4kyaF-3tq9A:
17.06
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
THR A  47
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
NDP  A1001 (-3.1A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.43A 4kyaG-3tq9A:
21.1		 4kyaG-3tq9A:
17.06
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_H_FOLH703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   8
ASP A  28
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.59A 4kyaH-3tq9A:
20.6		 4kyaH-3tq9A:
17.06
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
ASP A  28
PHE A  32
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.27A 4m2xA-3tq9A:
23.0		 4m2xA-3tq9A:
35.48
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.25A 4m2xC-3tq9A:
9.1		 4m2xC-3tq9A:
35.48
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.27A 4m2xE-3tq9A:
9.1		 4m2xE-3tq9A:
35.48
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A   6
ALA A   8
ASP A  28
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.22A 4m2xG-3tq9A:
9.0		 4m2xG-3tq9A:
35.48
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  21
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.49A 4m6kA-3tq9A:
21.7		 4m6kA-3tq9A:
30.35
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.13A 4nx6A-3tq9A:
26.1		 4nx6A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.45A 4nx6A-3tq9A:
26.1		 4nx6A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.26A 4nx6A-3tq9A:
26.1		 4nx6A-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX6_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ILE A   6
ASP A  28
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.24A 4nx6A-3tq9A:
26.1		 4nx6A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.50A 4nx7A-3tq9A:
26.1		 4nx7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.19A 4nx7A-3tq9A:
26.1		 4nx7A-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NX7_A_FOLA202_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ILE A   6
ASP A  28
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.27A 4nx7A-3tq9A:
26.1		 4nx7A-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
PRO A  56
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.23A 4p3qA-3tq9A:
25.9		 4p3qA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
PRO A  56
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 0.62A 4p3qA-3tq9A:
25.9		 4p3qA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
THR A  47
ILE A  51
LEU A  55
PRO A  56
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 ( 4.2A)
 0.34A 4p3qA-3tq9A:
25.9		 4p3qA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
THR A  47
ILE A  51
LEU A  55
PRO A  56
ILE A  96
 None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 ( 4.2A)
 1.27A 4p3qA-3tq9A:
25.9		 4p3qA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3Q_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 5 ASP A  28
LEU A  29
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.44A 4p3qA-3tq9A:
25.9		 4p3qA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.25A 4p3rA-3tq9A:
26.1		 4p3rA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.35A 4p3rA-3tq9A:
26.1		 4p3rA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.29A 4p3rA-3tq9A:
26.1		 4p3rA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4P3R_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ASP A  28
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.27A 4p3rA-3tq9A:
26.1		 4p3rA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 11 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.35A 4p66A-3tq9A:
25.8		 4p66A-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 11 ILE A   6
ASP A  28
PHE A  32
LYS A  33
ILE A  51
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.50A 4p68A-3tq9A:
25.4		 4p68A-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 11 ILE A   6
ASP A  28
PHE A  32
SER A  50
ILE A  51
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-4.3A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.46A 4p68A-3tq9A:
25.4		 4p68A-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
ALA A  30
PHE A  32
THR A  47
ILE A  51
LEU A  55
ILE A  96
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 ( 4.8A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 0.28A 4pssA-3tq9A:
undetectable		 4pssA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
ALA A  30
PHE A  32
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 ( 4.8A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.19A 4pssA-3tq9A:
undetectable		 4pssA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PSS_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 4 ASP A  28
LYS A  33
ARG A  58
THR A 115
 MTX  A2001 (-2.7A)
None
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.27A 4pssA-3tq9A:
undetectable		 4pssA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.28A 4pstA-3tq9A:
undetectable		 4pstA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.34A 4pstA-3tq9A:
undetectable		 4pstA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ILE A   6
ASP A  28
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 (-2.7A)
MTX  A2001 (-2.8A)
 0.29A 4pstA-3tq9A:
undetectable		 4pstA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
ALA A  30
PHE A  32
LYS A  33
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 ( 4.8A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.34A 4psyA-3tq9A:
26.0		 4psyA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.96A 4pthA-3tq9A:
25.7		 4pthA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.24A 4pthA-3tq9A:
25.7		 4pthA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 None
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.09A 4pthA-3tq9A:
25.7		 4pthA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.36A 4pthA-3tq9A:
25.7		 4pthA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4PTH_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ASP A  28
LEU A  29
PHE A  32
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
 0.30A 4pthA-3tq9A:
25.7		 4pthA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
 1.14A 4ptjA-3tq9A:
25.9		 4ptjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.24A 4ptjA-3tq9A:
25.9		 4ptjA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.63A 4q0dA-3tq9A:
22.2		 4q0dA-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.63A 4q0dB-3tq9A:
22.2		 4q0dB-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.73A 4q0dC-3tq9A:
22.2		 4q0dC-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
SER A  50
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.74A 4q0dD-3tq9A:
22.2		 4q0dD-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ALA A   8
LEU A  21
ASP A  28
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-4.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.63A 4q0dE-3tq9A:
22.3		 4q0dE-3tq9A:
19.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.07A 4qi9A-3tq9A:
23.0		 4qi9A-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.51A 4qi9A-3tq9A:
23.0		 4qi9A-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A 113
ALA A   8
ASP A  28
ILE A  41
THR A 115
 None
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
 1.07A 4qi9A-3tq9A:
23.0		 4qi9A-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.52A 4qi9B-3tq9A:
23.3		 4qi9B-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.04A 4qi9C-3tq9A:
22.4		 4qi9C-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 11 ILE A   6
ALA A   8
ASP A  28
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.52A 4qi9C-3tq9A:
22.4		 4qi9C-3tq9A:
47.93
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.09A 4qleA-3tq9A:
24.8		 4qleA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.47A 4qleA-3tq9A:
24.8		 4qleA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A 113
ALA A   8
ASP A  28
ILE A  41
THR A 115
 None
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
 1.01A 4qleA-3tq9A:
24.8		 4qleA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ALA A   7
SER A  50
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.07A 4qleB-3tq9A:
24.6		 4qleB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 11 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.52A 4qleB-3tq9A:
24.6		 4qleB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 11 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.38A 4qlfA-3tq9A:
21.6		 4qlfA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 11 ILE A 113
ALA A   8
ASP A  28
ILE A  41
THR A 115
 None
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
 1.04A 4qlfA-3tq9A:
21.6		 4qlfA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.37A 4qlgA-3tq9A:
24.6		 4qlgA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A 113
ALA A   8
ASP A  28
ILE A  41
THR A 115
 None
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
 1.02A 4qlgA-3tq9A:
24.6		 4qlgA-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.07A 4qlgB-3tq9A:
24.2		 4qlgB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		11 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.35A 4qlgB-3tq9A:
24.2		 4qlgB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.12A 4qlgB-3tq9A:
24.2		 4qlgB-3tq9A:
43.37
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.02A 4rgcA-3tq9A:
26.1		 4rgcA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.35A 4rgcA-3tq9A:
26.1		 4rgcA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.04A 4x5fA-3tq9A:
24.4		 4x5fA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.26A 4x5fA-3tq9A:
24.4		 4x5fA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.67A 4x5fA-3tq9A:
24.4		 4x5fA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.10A 4x5fB-3tq9A:
24.9		 4x5fB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.72A 4x5fB-3tq9A:
24.9		 4x5fB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.28A 4x5fB-3tq9A:
24.9		 4x5fB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.09A 4x5gA-3tq9A:
24.5		 4x5gA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.33A 4x5gA-3tq9A:
24.5		 4x5gA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.70A 4x5gA-3tq9A:
24.5		 4x5gA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.91A 4x5gB-3tq9A:
25.0		 4x5gB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.30A 4x5gB-3tq9A:
25.0		 4x5gB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 LEU A  29
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
ILE A  96
 MTX  A2001 (-3.9A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 ( 4.2A)
 0.74A 4x5gB-3tq9A:
25.0		 4x5gB-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.03A 4x5hA-3tq9A:
24.1		 4x5hA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.38A 4x5hA-3tq9A:
24.1		 4x5hA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 0.66A 4x5hA-3tq9A:
24.1		 4x5hA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.48A 4x5iA-3tq9A:
23.8		 4x5iA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
THR A  47
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.42A 4x5jA-3tq9A:
23.8		 4x5jA-3tq9A:
42.86
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.
4ZZC_A_ACTA401_0
(PROTON-GATED ION
CHANNEL)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 6 ILE A   6
PHE A  32
ARG A  58
ILE A  41
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
None
 1.37A 4zzcA-3tq9A:
undetectable
4zzcB-3tq9A:
undetectable		 4zzcA-3tq9A:
20.32
4zzcB-3tq9A:
20.32
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.
4ZZC_B_ACTB401_0
(PROTON-GATED ION
CHANNEL)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 6 ILE A   6
PHE A  32
ARG A  58
ILE A  41
 MTX  A2001 (-4.0A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
None
 1.38A 4zzcB-3tq9A:
undetectable
4zzcC-3tq9A:
undetectable		 4zzcB-3tq9A:
20.32
4zzcC-3tq9A:
20.32
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.43A 5e8qA-3tq9A:
24.0		 5e8qA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5E8Q_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ASP A  28
LEU A  55
ARG A  58
 MTX  A2001 (-2.7A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 0.37A 5e8qA-3tq9A:
24.0		 5e8qA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
 1.05A 5e8qB-3tq9A:
24.5		 5e8qB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-4.3A)
 0.49A 5e8qB-3tq9A:
24.5		 5e8qB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.51A 5eajA-3tq9A:
24.0		 5eajA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.45A 5eajA-3tq9A:
24.0		 5eajA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
PRO A  56
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.20A 5eajB-3tq9A:
24.5		 5eajB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
PRO A  56
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
MTX  A2001 (-4.3A)
 0.54A 5eajB-3tq9A:
24.5		 5eajB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
PRO A  56
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.22A 5eajB-3tq9A:
24.5		 5eajB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.55A 5hi6A-3tq9A:
24.5		 5hi6A-3tq9A:
46.30
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
SER A  50
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
NDP  A1001 ( 3.0A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.60A 5hi6B-3tq9A:
24.5		 5hi6B-3tq9A:
46.30
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
ASP A  28
LEU A  29
SER A  50
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
NDP  A1001 ( 3.0A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.44A 5hi6B-3tq9A:
24.5		 5hi6B-3tq9A:
46.30
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ILE A 113
ALA A   8
ASP A  28
ILE A  41
THR A 115
 None
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
 1.10A 5hi6B-3tq9A:
24.5		 5hi6B-3tq9A:
46.30
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 8 ILE A   6
ALA A   8
ASP A  28
LEU A  29
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.40A 5uihA-3tq9A:
23.8		 5uihA-3tq9A:
32.65
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.46A 5ujxA-3tq9A:
24.1		 5ujxA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 LEU A  29
PHE A  32
LYS A  33
ILE A  51
LEU A  55
ILE A  41
 MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
None
 1.46A 5ujxA-3tq9A:
24.1		 5ujxA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
LEU A  55
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
 1.04A 5ujxB-3tq9A:
24.5		 5ujxB-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.46A 5ujxB-3tq9A:
24.5		 5ujxB-3tq9A:
43.98
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.
5Y7P_C_CHDC401_0
(BILE SALT HYDROLASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		4 / 8 LEU A  55
ILE A   6
LEU A  25
LEU A  21
 MTX  A2001 ( 4.5A)
MTX  A2001 (-4.0A)
None
MTX  A2001 (-4.4A)
 0.79A 5y7pC-3tq9A:
undetectable		 5y7pC-3tq9A:
22.09
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 12 ALA A   7
PHE A  32
THR A  47
ILE A  51
ARG A  58
 NDP  A1001 ( 4.1A)
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
 1.16A 5z6fA-3tq9A:
26.2		 5z6fA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
ARG A  58
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 (-2.8A)
MTX  A2001 (-4.3A)
 0.32A 5z6fA-3tq9A:
26.2		 5z6fA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.36A 5z6jA-3tq9A:
26.4		 5z6jA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.35A 5z6jA-3tq9A:
26.4		 5z6jA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		10 / 12 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.41A 5z6kA-3tq9A:
26.3		 5z6kA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.39A 5z6kA-3tq9A:
26.3		 5z6kA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		8 / 9 ILE A   6
ALA A   8
ASP A  28
LEU A  29
LYS A  33
ILE A  51
PRO A  56
ARG A  58
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
None
MTX  A2001 (-4.3A)
None
MTX  A2001 (-2.8A)
 0.62A 5z6lA-3tq9A:
25.5		 5z6lA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 9 ILE A  94
LYS A  33
ILE A  51
PRO A  56
ARG A  58
 None
None
MTX  A2001 (-4.3A)
None
MTX  A2001 (-2.8A)
 1.24A 5z6lA-3tq9A:
25.5		 5z6lA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 11 ALA A   8
ASP A  28
LEU A  29
PHE A  32
ILE A  96
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.82A 5z6mA-3tq9A:
24.7		 5z6mA-3tq9A:
42.86
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		7 / 11 ILE A   6
ALA A   8
LEU A  29
PHE A  32
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-3.9A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.76A 5z6mA-3tq9A:
24.7		 5z6mA-3tq9A:
42.86
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.
5ZJI_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		5 / 10 PHE A 127
GLY A  97
ILE A   3
ALA A 105
LEU A 106
 None
NDP  A1001 ( 3.8A)
None
None
None
 1.22A 5zjiA-3tq9A:
undetectable
5zjiJ-3tq9A:
undetectable		 5zjiA-3tq9A:
15.17
5zjiJ-3tq9A:
15.48
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.
6AOG_A_CP6A704_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 10 ALA A   8
ASP A  28
HIS A  31
PHE A  32
THR A  47
THR A 115
 MTX  A2001 ( 3.4A)
MTX  A2001 (-2.7A)
None
MTX  A2001 (-4.3A)
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
 0.30A 6aogA-3tq9A:
21.1		 6aogA-3tq9A:
26.12
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		9 / 12 ILE A   6
ALA A   8
PHE A  32
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
THR A 115
 MTX  A2001 (-4.0A)
MTX  A2001 ( 3.4A)
MTX  A2001 (-4.3A)
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
MTX  A2001 (-4.3A)
 0.48A 7dfrA-3tq9A:
25.5		 7dfrA-3tq9A:
43.98
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)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		6 / 12 ILE A  94
LYS A  33
THR A  47
ILE A  51
LEU A  55
ILE A  96
 None
None
NDP  A1001 (-3.1A)
MTX  A2001 (-4.3A)
MTX  A2001 ( 4.5A)
MTX  A2001 ( 4.2A)
 1.38A 7dfrA-3tq9A:
25.5		 7dfrA-3tq9A:
43.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
7DFR_A_FOLA161_1
(DIHYDROFOLATE
REDUCTASE)		 3tq9 DIHYDROFOLATE
REDUCTASE
(Coxiella
burnetii) 		3 / 3 ASP A  28
LEU A  29
ARG A  58
 MTX  A2001 (-2.7A)
MTX  A2001 (-3.9A)
MTX  A2001 (-2.8A)
 0.28A 7dfrA-3tq9A:
25.5		 7dfrA-3tq9A:
43.98