SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qk8'

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.
1CD2_A_FOLA307_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
LYS A  33
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.61A 1cd2A-2qk8A:
20.7		 1cd2A-2qk8A:
30.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1D1G_A_MTXA171_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
ILE A  51
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.69A 1d1gA-2qk8A:
19.9		 1d1gA-2qk8A:
29.55
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
ILE A  51
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.55A 1d1gB-2qk8A:
20.0		 1d1gB-2qk8A:
29.55
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.79A 1ddrA-2qk8A:
23.9		 1ddrA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.69A 1ddrB-2qk8A:
24.2		 1ddrB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
None
MTX  A 200 ( 4.4A)
 0.85A 1ddsA-2qk8A:
24.3		 1ddsA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.56A 1ddsA-2qk8A:
24.3		 1ddsA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.70A 1ddsB-2qk8A:
24.5		 1ddsB-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.75A 1dhfA-2qk8A:
20.7		 1dhfA-2qk8A:
33.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.76A 1dhfB-2qk8A:
20.8		 1dhfB-2qk8A:
33.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 1dhiA-2qk8A:
24.2		 1dhiA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 11 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.61A 1dhiB-2qk8A:
24.6		 1dhiB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.60A 1dhjA-2qk8A:
24.3		 1dhjA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
PRO A  56
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.65A 1dhjB-2qk8A:
24.7		 1dhjB-2qk8A:
40.37
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
GLU A  28
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.63A 1dlsA-2qk8A:
21.5		 1dlsA-2qk8A:
33.33
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
GLU A  28
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.58A 1draA-2qk8A:
24.5		 1draA-2qk8A:
41.61
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 12 ALA A   8
GLU A  28
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.58A 1draB-2qk8A:
24.7		 1draB-2qk8A:
41.61
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
GLU A  28
LYS A  33
LEU A  41
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 1.48A 1draB-2qk8A:
24.7		 1draB-2qk8A:
41.61
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.65A 1drbA-2qk8A:
24.3		 1drbA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.62A 1drbB-2qk8A:
24.7		 1drbB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.57A 1dreA-2qk8A:
25.2		 1dreA-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1DRF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.84A 1drfA-2qk8A:
21.2		 1drfA-2qk8A:
33.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.60A 1dyiA-2qk8A:
24.3		 1dyiA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 1dyiB-2qk8A:
24.4		 1dyiB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
GLU A  28
ILE A  51
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.2A)
None
MTX  A 200 ( 4.4A)
 0.43A 1dyrA-2qk8A:
20.1		 1dyrA-2qk8A:
30.85
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
LEU A  21
GLU A  28
ILE A  51
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.4A)
 0.84A 1dyrA-2qk8A:
20.1		 1dyrA-2qk8A:
30.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J3J_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 9 ALA A   8
ASN A  47
ILE A  51
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
None
MTX  A 200 ( 4.4A)
 0.63A 1j3jB-2qk8A:
20.2		 1j3jB-2qk8A:
24.55
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.62A 1jolA-2qk8A:
24.4		 1jolA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
PRO A  56
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
None
MTX  A 200 ( 4.4A)
 0.68A 1jolB-2qk8A:
24.7		 1jolB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 11 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 1jomA-2qk8A:
23.9		 1jomA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.87A 1qzfA-2qk8A:
12.0		 1qzfA-2qk8A:
16.91
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.
1QZF_A_FOLA605_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.69A 1qzfA-2qk8A:
12.0		 1qzfA-2qk8A:
16.91
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.
1QZF_B_FOLB609_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.87A 1qzfB-2qk8A:
20.0		 1qzfB-2qk8A:
16.91
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.
1QZF_B_FOLB609_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.70A 1qzfB-2qk8A:
20.0		 1qzfB-2qk8A:
16.91
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.
1QZF_C_FOLC613_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.87A 1qzfC-2qk8A:
12.6		 1qzfC-2qk8A:
16.91
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.
1QZF_C_FOLC613_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.69A 1qzfC-2qk8A:
12.6		 1qzfC-2qk8A:
16.91
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.
1QZF_D_FOLD617_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.88A 1qzfD-2qk8A:
11.9		 1qzfD-2qk8A:
16.91
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.
1QZF_D_FOLD617_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.69A 1qzfD-2qk8A:
11.9		 1qzfD-2qk8A:
16.91
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.
1QZF_E_FOLE621_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.88A 1qzfE-2qk8A:
12.0		 1qzfE-2qk8A:
16.91
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.
1QZF_E_FOLE621_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.71A 1qzfE-2qk8A:
12.0		 1qzfE-2qk8A:
16.91
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.66A 1ra2A-2qk8A:
24.2		 1ra2A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.56A 1ra3A-2qk8A:
24.3		 1ra3A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.62A 1ra8A-2qk8A:
24.1		 1ra8A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.65A 1rb2A-2qk8A:
24.4		 1rb2A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.62A 1rb2B-2qk8A:
24.3		 1rb2B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.87A 1rb2B-2qk8A:
24.3		 1rb2B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 10 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.58A 1rb3A-2qk8A:
24.6		 1rb3A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 1.03A 1rb3B-2qk8A:
24.7		 1rb3B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 1rd7A-2qk8A:
23.8		 1rd7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 1rd7B-2qk8A:
23.8		 1rd7B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
None
MTX  A 200 ( 4.4A)
 0.63A 1re7A-2qk8A:
24.1		 1re7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
PRO A  56
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 1re7B-2qk8A:
23.8		 1re7B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.62A 1rg7A-2qk8A:
23.6		 1rg7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 1.35A 1rg7A-2qk8A:
23.6		 1rg7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.60A 1rh3A-2qk8A:
25.1		 1rh3A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.86A 1rx2A-2qk8A:
25.6		 1rx2A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.82A 1rx2A-2qk8A:
25.6		 1rx2A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.83A 1rx3A-2qk8A:
25.4		 1rx3A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.70A 1rx7A-2qk8A:
23.6		 1rx7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 1.01A 1rx8A-2qk8A:
25.1		 1rx8A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
PRO A  56
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
None
MTX  A 200 ( 4.4A)
 0.70A 1rx8A-2qk8A:
25.1		 1rx8A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
PRO A  56
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 4.4A)
 0.85A 1rx8A-2qk8A:
25.1		 1rx8A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.71A 1tdrA-2qk8A:
24.5		 1tdrA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 10 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.64A 1tdrB-2qk8A:
24.6		 1tdrB-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1U70_A_MTXA187_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
GLU A  28
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.49A 1u70A-2qk8A:
20.9		 1u70A-2qk8A:
33.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1U72_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.78A 1u72A-2qk8A:
21.4		 1u72A-2qk8A:
33.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
ILE A  51
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
None
MTX  A 200 ( 4.4A)
 0.88A 2bl9A-2qk8A:
20.3		 2bl9A-2qk8A:
25.71
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.54A 2cd2A-2qk8A:
20.9		 2cd2A-2qk8A:
30.85
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
ILE A  51
LEU A  55
PRO A  56
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.74A 2d0kA-2qk8A:
23.3		 2d0kA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
PRO A  56
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.63A 2d0kA-2qk8A:
23.3		 2d0kA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.91A 2d0kB-2qk8A:
23.6		 2d0kB-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.71A 2d0kB-2qk8A:
23.6		 2d0kB-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.57A 2drcA-2qk8A:
24.3		 2drcA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.61A 2drcB-2qk8A:
24.6		 2drcB-2qk8A:
40.37
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.
2OIP_A_MTXA605_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
 0.82A 2oipA-2qk8A:
20.7		 2oipA-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.63A 2oipA-2qk8A:
20.7		 2oipA-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.71A 2oipB-2qk8A:
19.1		 2oipB-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.71A 2oipC-2qk8A:
20.5		 2oipC-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.85A 2oipD-2qk8A:
9.1		 2oipD-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.84A 2oipE-2qk8A:
20.4		 2oipE-2qk8A:
16.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
GLU A  28
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.66A 2w3aB-2qk8A:
20.8		 2w3aB-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.82A 2w3bA-2qk8A:
20.8		 2w3bA-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.87A 2w3bB-2qk8A:
20.8		 2w3bB-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.80A 2w3mA-2qk8A:
20.9		 2w3mA-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 LEU A  21
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 1.00A 2w3mA-2qk8A:
20.9		 2w3mA-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.74A 2w3mB-2qk8A:
21.0		 2w3mB-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 10 ALA A   8
LEU A  21
LEU A  29
VAL A  32
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.78A 2w9gA-2qk8A:
25.2		 2w9gA-2qk8A:
46.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 10 ALA A   8
LEU A  21
LEU A  29
VAL A  32
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.80A 2w9hA-2qk8A:
25.4		 2w9hA-2qk8A:
46.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 11 ALA A   8
LEU A  21
LEU A  29
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.75A 2w9sA-2qk8A:
25.3		 2w9sA-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 11 ALA A   8
LEU A  29
ILE A  51
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.51A 2w9sA-2qk8A:
25.3		 2w9sA-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 11 ALA A   8
LEU A  21
LEU A  29
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.76A 2w9sB-2qk8A:
25.4		 2w9sB-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 11 ALA A   8
LEU A  29
ILE A  51
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.50A 2w9sB-2qk8A:
25.4		 2w9sB-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
ILE A  51
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.43A 2w9sC-2qk8A:
25.4		 2w9sC-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
LEU A  21
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.77A 2w9sC-2qk8A:
25.4		 2w9sC-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
LEU A  29
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.50A 2w9sD-2qk8A:
24.7		 2w9sD-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		4 / 8 ALA A   8
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.34A 2w9sE-2qk8A:
24.7		 2w9sE-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
LEU A  29
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.50A 2w9sF-2qk8A:
24.6		 2w9sF-2qk8A:
44.24
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
GLU A  28
LEU A  29
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.61A 2zzaA-2qk8A:
26.2		 2zzaA-2qk8A:
44.44
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
GLU A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.57A 2zzaA-2qk8A:
26.2		 2zzaA-2qk8A:
44.44
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 11 ALA A   8
GLU A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.79A 2zzaB-2qk8A:
26.2		 2zzaB-2qk8A:
44.44
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 GLU A  28
LYS A  33
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.54A 3cd2A-2qk8A:
20.4		 3cd2A-2qk8A:
30.85
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 LEU A  21
GLU A  28
LYS A  33
LEU A  55
ARG A  58
 MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
 0.85A 3cd2A-2qk8A:
20.4		 3cd2A-2qk8A:
30.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CL9_A_MTXA602_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE (DHFR-TS))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  55
PRO A  56
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 2.8A)
None
 0.71A 3cl9A-2qk8A:
18.5		 3cl9A-2qk8A:
16.15
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.67A 3clbA-2qk8A:
18.8		 3clbA-2qk8A:
16.15
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.65A 3clbC-2qk8A:
18.8		 3clbC-2qk8A:
16.15
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		11 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
VAL A  32
ILE A  51
ARG A  53
LEU A  55
ARG A  58
PHE A  96
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 3.9A)
None
 0.48A 3datA-2qk8A:
29.2		 3datA-2qk8A:
100.00
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		11 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
VAL A  32
ILE A  51
ARG A  53
LEU A  55
ARG A  58
PHE A  96
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 3.9A)
None
 0.51A 3datA-2qk8A:
29.2		 3datA-2qk8A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3DAT_A_MTXA201_2
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		4 / 4 MET A   6
LYS A  33
ASN A  47
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.4A)
 0.24A 3datA-2qk8A:
29.2		 3datA-2qk8A:
100.00
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
ARG A  58
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
 0.83A 3dauA-2qk8A:
25.5		 3dauA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.58A 3dauA-2qk8A:
25.5		 3dauA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.75A 3dfrA-2qk8A:
25.0		 3dfrA-2qk8A:
38.32
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.58A 3drcA-2qk8A:
24.3		 3drcA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 3drcB-2qk8A:
24.7		 3drcB-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3EIG_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.68A 3eigA-2qk8A:
21.2		 3eigA-2qk8A:
33.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_A_TOPA200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 10 MET A   6
ALA A   8
LEU A  21
GLU A  28
VAL A  32
ALA A  50
ILE A  51
LEU A  55
PHE A  96
TYR A 102
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.0A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
None
 0.75A 3fl9A-2qk8A:
28.0		 3fl9A-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ASN A  20
LEU A  21
GLU A  28
LEU A  29
PHE A  96
TYR A 102
THR A 115
 None
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.90A 3fl9B-2qk8A:
27.8		 3fl9B-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		11 / 12 MET A   6
ALA A   8
LEU A  21
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.73A 3fl9B-2qk8A:
27.8		 3fl9B-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
GLU A  28
VAL A  32
LEU A  41
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
None
MTX  A 200 ( 4.4A)
 1.21A 3fl9C-2qk8A:
28.1		 3fl9C-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 11 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.53A 3fl9C-2qk8A:
28.1		 3fl9C-2qk8A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_D_TOPD200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 9 MET A   6
ALA A   8
LEU A  21
GLU A  28
VAL A  32
ILE A  51
LEU A  55
PHE A  96
TYR A 102
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
None
 0.67A 3fl9D-2qk8A:
28.3		 3fl9D-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 10 ALA A   8
GLU A  28
VAL A  32
LEU A  41
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
None
MTX  A 200 ( 4.4A)
 1.14A 3fl9E-2qk8A:
28.2		 3fl9E-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 10 LEU A  21
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.76A 3fl9E-2qk8A:
28.2		 3fl9E-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 10 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.49A 3fl9E-2qk8A:
28.2		 3fl9E-2qk8A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3FL9_F_TOPF200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 10 MET A   6
ALA A   8
LEU A  21
GLU A  28
VAL A  32
ALA A  50
ILE A  51
LEU A  55
PHE A  96
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.0A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
 0.79A 3fl9F-2qk8A:
27.7		 3fl9F-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.73A 3fl9G-2qk8A:
27.7		 3fl9G-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 12 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.54A 3fl9G-2qk8A:
27.7		 3fl9G-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 9 ALA A   8
GLU A  28
VAL A  32
LEU A  41
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
None
MTX  A 200 ( 4.4A)
 1.22A 3fl9H-2qk8A:
28.2		 3fl9H-2qk8A:
100.00
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))		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 9 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.52A 3fl9H-2qk8A:
28.2		 3fl9H-2qk8A:
100.00
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 11 ALA A   8
LEU A  21
LEU A  29
VAL A  32
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.76A 3frbX-2qk8A:
25.1		 3frbX-2qk8A:
46.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 11 ALA A   8
LEU A  29
VAL A  32
ILE A  51
PHE A  96
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
None
MTX  A 200 ( 4.4A)
 0.50A 3frbX-2qk8A:
25.1		 3frbX-2qk8A:
46.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 9 ALA A   8
LEU A  21
LEU A  29
VAL A  32
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.78A 3freX-2qk8A:
25.1		 3freX-2qk8A:
45.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HBB_C_TMQC613_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 3hbbC-2qk8A:
18.6		 3hbbC-2qk8A:
16.15
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.73A 3hj3A-2qk8A:
21.5		 3hj3A-2qk8A:
16.91
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.
3HJ3_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.73A 3hj3B-2qk8A:
21.6		 3hj3B-2qk8A:
16.91
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.
3HJ3_C_MTXC613_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.70A 3hj3C-2qk8A:
20.1		 3hj3C-2qk8A:
16.91
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.
3HJ3_D_MTXD615_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.81A 3hj3D-2qk8A:
17.3		 3hj3D-2qk8A:
16.91
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.60A 3ia4A-2qk8A:
26.0		 3ia4A-2qk8A:
45.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.51A 3ia4B-2qk8A:
26.2		 3ia4B-2qk8A:
45.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.69A 3ia4C-2qk8A:
25.9		 3ia4C-2qk8A:
45.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
GLU A  28
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.41A 3ia4D-2qk8A:
26.1		 3ia4D-2qk8A:
45.06
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
GLN A  30
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.4A)
 1.06A 3ix9A-2qk8A:
25.7		 3ix9A-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.79A 3ix9A-2qk8A:
25.7		 3ix9A-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.73A 3ix9B-2qk8A:
26.0		 3ix9B-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
GLU A  28
LEU A  29
GLN A  30
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.53A 3ix9B-2qk8A:
26.0		 3ix9B-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.82A 3ix9B-2qk8A:
26.0		 3ix9B-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
GLU A  28
LEU A  29
LYS A  33
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.77A 3ix9B-2qk8A:
26.0		 3ix9B-2qk8A:
37.17
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 10 MET A   6
ALA A   8
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.64A 3jw3A-2qk8A:
28.4		 3jw3A-2qk8A:
98.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 9 MET A   6
ALA A   8
LEU A  21
GLU A  28
VAL A  32
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.76A 3jw3B-2qk8A:
28.4		 3jw3B-2qk8A:
98.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		11 / 11 MET A   6
ALA A   8
ASN A  20
LEU A  21
GLU A  28
LEU A  29
VAL A  32
ASN A  47
ILE A  51
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
None
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.75A 3jw5A-2qk8A:
28.4		 3jw5A-2qk8A:
98.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		10 / 10 MET A   6
ALA A   8
LEU A  21
GLU A  28
LEU A  29
VAL A  32
ILE A  51
LEU A  55
PHE A  96
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.7A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 3.9A)
MTX  A 200 ( 4.4A)
 0.58A 3jw5B-2qk8A:
28.4		 3jw5B-2qk8A:
98.77
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.61A 3k2hA-2qk8A:
21.6		 3k2hA-2qk8A:
13.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.60A 3k2hB-2qk8A:
21.0		 3k2hB-2qk8A:
13.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3N0H_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 11 ALA A   8
GLU A  28
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.86A 3n0hA-2qk8A:
20.7		 3n0hA-2qk8A:
33.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 ALA A   8
ASN A  47
ILE A  51
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
None
MTX  A 200 ( 4.4A)
 0.68A 3qg2B-2qk8A:
20.2		 3qg2B-2qk8A:
12.60
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.61A 3ql0A-2qk8A:
25.6		 3ql0A-2qk8A:
40.74
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
None
MTX  A 200 ( 4.4A)
 0.94A 3ql3A-2qk8A:
25.6		 3ql3A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.82A 3ql3A-2qk8A:
25.6		 3ql3A-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3S3V_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
GLU A  28
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.95A 3s3vA-2qk8A:
20.6		 3s3vA-2qk8A:
34.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3TQ9_A_MTXA2001_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.71A 3tq9A-2qk8A:
25.4		 3tq9A-2qk8A:
38.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 11 ALA A   8
LEU A  21
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.72A 3tqbA-2qk8A:
25.2		 3tqbA-2qk8A:
38.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
GLU A  28
LYS A  33
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.72A 4cd2A-2qk8A:
19.7		 4cd2A-2qk8A:
30.85
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.61A 4dfrA-2qk8A:
24.2		 4dfrA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.69A 4dfrB-2qk8A:
24.7		 4dfrB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.70A 4eckA-2qk8A:
18.9		 4eckA-2qk8A:
14.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ECK_B_FOLB703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.82A 4eckB-2qk8A:
18.7		 4eckB-2qk8A:
14.74
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
 0.67A 4ej1A-2qk8A:
23.6		 4ej1A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  29
LYS A  33
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.66A 4ej1B-2qk8A:
23.4		 4ej1B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.65A 4ej1B-2qk8A:
23.4		 4ej1B-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 4fhbA-2qk8A:
24.4		 4fhbA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 0.57A 4gh8A-2qk8A:
24.8		 4gh8A-2qk8A:
39.63
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
 0.56A 4gh8B-2qk8A:
24.6		 4gh8B-2qk8A:
39.63
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.78A 4i13A-2qk8A:
23.8		 4i13A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 11 ALA A   8
LEU A  29
LYS A  33
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.65A 4i1nA-2qk8A:
24.0		 4i1nA-2qk8A:
40.99
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KEB_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.92A 4kebB-2qk8A:
21.0		 4kebB-2qk8A:
33.87
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.93A 4kfjB-2qk8A:
21.2		 4kfjB-2qk8A:
33.87
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.67A 4kjjA-2qk8A:
24.6		 4kjjA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.68A 4kjkA-2qk8A:
25.4		 4kjkA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.50A 4kjlA-2qk8A:
25.1		 4kjlA-2qk8A:
40.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KY8_A_MTXA603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.78A 4ky8A-2qk8A:
14.2		 4ky8A-2qk8A:
16.91
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.
4KY8_B_MTXB603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.77A 4ky8B-2qk8A:
15.2		 4ky8B-2qk8A:
16.91
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.
4KY8_C_MTXC603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.81A 4ky8C-2qk8A:
21.2		 4ky8C-2qk8A:
16.91
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.
4KY8_D_MTXD603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.81A 4ky8D-2qk8A:
17.8		 4ky8D-2qk8A:
16.91
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.
4KY8_E_MTXE603_1
(BIFUNCTIONAL
THYMIDYLATE
SYNTHASE-DIHYDROFOLA
TE REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.83A 4ky8E-2qk8A:
21.2		 4ky8E-2qk8A:
16.91
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 4m6kA-2qk8A:
21.5		 4m6kA-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  21
ILE A  51
LEU A  55
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.4A)
 0.83A 4m6kA-2qk8A:
21.5		 4m6kA-2qk8A:
34.76
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
 0.84A 4nx6A-2qk8A:
25.7		 4nx6A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.78A 4nx6A-2qk8A:
25.7		 4nx6A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
 0.85A 4nx7A-2qk8A:
25.7		 4nx7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.85A 4nx7A-2qk8A:
25.7		 4nx7A-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
PRO A  56
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
None
 1.02A 4p3qA-2qk8A:
25.5		 4p3qA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		4 / 5 LEU A  29
ARG A  53
ARG A  58
THR A 115
 MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.76A 4p3qA-2qk8A:
25.5		 4p3qA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.72A 4p3rA-2qk8A:
25.7		 4p3rA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 11 ALA A   8
LEU A  29
LYS A  33
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.60A 4p66A-2qk8A:
25.4		 4p66A-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 11 LYS A  33
ILE A  51
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.62A 4p68A-2qk8A:
24.9		 4p68A-2qk8A:
39.75
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
 0.60A 4pssA-2qk8A:
undetectable		 4pssA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.61A 4pstA-2qk8A:
undetectable		 4pstA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.57A 4psyA-2qk8A:
25.7		 4psyA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.67A 4pthA-2qk8A:
25.4		 4pthA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.54A 4ptjA-2qk8A:
25.7		 4ptjA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.76A 4q0dA-2qk8A:
21.2		 4q0dA-2qk8A:
16.91
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.
4Q0D_B_MTXB604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.75A 4q0dB-2qk8A:
21.3		 4q0dB-2qk8A:
16.91
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.
4Q0D_C_MTXC604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.73A 4q0dC-2qk8A:
21.3		 4q0dC-2qk8A:
16.91
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.
4Q0D_D_MTXD604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  21
LEU A  29
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.73A 4q0dD-2qk8A:
21.3		 4q0dD-2qk8A:
16.91
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.
4Q0D_E_MTXE604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  21
LEU A  29
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.5A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.75A 4q0dE-2qk8A:
21.3		 4q0dE-2qk8A:
16.91
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.67A 4qi9A-2qk8A:
23.1		 4qi9A-2qk8A:
38.69
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.67A 4qi9B-2qk8A:
23.4		 4qi9B-2qk8A:
38.69
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 11 ALA A   8
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.67A 4qi9C-2qk8A:
22.7		 4qi9C-2qk8A:
38.69
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.59A 4qleA-2qk8A:
24.5		 4qleA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 11 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.59A 4qleB-2qk8A:
24.6		 4qleB-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 11 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.77A 4qlfA-2qk8A:
21.5		 4qlfA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.68A 4qlgA-2qk8A:
24.5		 4qlgA-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.62A 4qlgB-2qk8A:
24.4		 4qlgB-2qk8A:
40.37
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.61A 4rgcA-2qk8A:
25.8		 4rgcA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.80A 4x5fA-2qk8A:
24.2		 4x5fA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.57A 4x5fB-2qk8A:
24.6		 4x5fB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
 1.13A 4x5fB-2qk8A:
24.6		 4x5fB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.79A 4x5gA-2qk8A:
24.3		 4x5gA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.63A 4x5gB-2qk8A:
24.7		 4x5gB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
 1.13A 4x5gB-2qk8A:
24.7		 4x5gB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  29
ARG A  53
LEU A  55
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.4A)
 0.74A 4x5hA-2qk8A:
23.7		 4x5hA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.73A 4x5hA-2qk8A:
23.7		 4x5hA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
 0.92A 4x5hA-2qk8A:
23.7		 4x5hA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.84A 4x5iA-2qk8A:
23.4		 4x5iA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
ILE A  51
ARG A  53
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
None
MTX  A 200 ( 4.4A)
 0.98A 4x5jA-2qk8A:
23.4		 4x5jA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 ALA A   8
LEU A  29
ARG A  53
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
None
MTX  A 200 ( 4.4A)
 1.07A 4x5jA-2qk8A:
23.4		 4x5jA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
None
MTX  A 200 ( 4.4A)
 0.49A 5e8qA-2qk8A:
24.3		 5e8qA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.83A 5e8qB-2qk8A:
24.6		 5e8qB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.56A 5e8qB-2qk8A:
24.6		 5e8qB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.58A 5eajA-2qk8A:
24.3		 5eajA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
PRO A  56
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.8A)
None
MTX  A 200 ( 4.4A)
 0.66A 5eajB-2qk8A:
24.6		 5eajB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.65A 5hi6A-2qk8A:
24.7		 5hi6A-2qk8A:
39.75
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		9 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.68A 5hi6B-2qk8A:
24.4		 5hi6B-2qk8A:
39.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		4 / 8 ALA A   8
LEU A  29
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
None
MTX  A 200 ( 4.4A)
 0.48A 5uihA-2qk8A:
23.6		 5uihA-2qk8A:
29.25
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  53
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.64A 5ujxA-2qk8A:
24.3		 5ujxA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		8 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.56A 5ujxB-2qk8A:
24.6		 5ujxB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		5 / 12 LEU A  29
ARG A  53
LEU A  55
ARG A  58
THR A 115
 MTX  A 200 ( 4.3A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.94A 5ujxB-2qk8A:
24.6		 5ujxB-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LEU A  29
ILE A  51
ARG A  53
ARG A  58
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 3.5A)
MTX  A 200 ( 2.8A)
MTX  A 200 ( 4.4A)
 0.68A 5z6fA-2qk8A:
25.7		 5z6fA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
ARG A  58
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 2.8A)
None
MTX  A 200 ( 4.4A)
 0.56A 5z6fA-2qk8A:
25.7		 5z6fA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.60A 5z6jA-2qk8A:
25.9		 5z6jA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		7 / 12 ALA A   8
LEU A  29
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.63A 5z6kA-2qk8A:
25.9		 5z6kA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 9 ALA A   8
LEU A  29
LYS A  33
ILE A  51
PRO A  56
ARG A  58
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.3A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.8A)
MTX  A 200 ( 2.8A)
 0.70A 5z6lA-2qk8A:
25.0		 5z6lA-2qk8A:
40.99
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)		 2qk8 DIHYDROFOLATE
REDUCTASE
(Bacillus
anthracis) 		6 / 12 ALA A   8
LYS A  33
ILE A  51
LEU A  55
TYR A 102
THR A 115
 MTX  A 200 ( 3.4A)
MTX  A 200 ( 4.1A)
MTX  A 200 ( 4.2A)
MTX  A 200 ( 4.1A)
None
MTX  A 200 ( 4.4A)
 0.56A 7dfrA-2qk8A:
25.4		 7dfrA-2qk8A:
40.99