SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ehc'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site

Query pattern: Residues from known binding site for annotated drug that match the hit pattern


(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
Interface HETATM RMSD Dali
Z-score
Seq.
Identity (%)
View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DZ4_B_CAMB502_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.04A 1dz4B-4ehcA:
undetectable
1dz4B-4ehcA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQH_B_FLPB1701_1
(PROSTAGLANDIN H2
SYNTHASE-1)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 VAL A  21
VAL A 142
ILE A 130
GLY A 117
LEU A  35
None
1.04A 1eqhB-4ehcA:
undetectable
1eqhB-4ehcA:
18.99
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.
1O76_B_CAMB1420_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 8 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.06A 1o76B-4ehcA:
undetectable
1o76B-4ehcA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P93_C_DEXC3999_1
(GLUCOCORTICOID
RECEPTOR)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 MET A 134
GLY A 141
LEU A 151
LEU A 116
THR A  90
None
1.34A 1p93C-4ehcA:
undetectable
1p93C-4ehcA:
21.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T69_A_SHHA379_1
(HISTONE DEACETYLASE
8)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 GLY A  66
ASP A  36
HIS A -16
ASP A 189
MET A 187
EDO  A 328 (-3.6A)
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.2A)
ZN  A 301 (-2.0A)
None
1.25A 1t69A-4ehcA:
undetectable
1t69A-4ehcA:
21.45
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.
1T7J_A_478A200_1
(POL POLYPROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 11 LEU A  34
ASP A  36
GLY A  38
GLY A  66
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
EDO  A 328 (-3.6A)
None
0.87A 1t7jA-4ehcA:
8.0
1t7jA-4ehcA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T7J_A_478A200_1
(POL POLYPROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 11 LEU A  34
ASP A  36
GLY A  38
VAL A  43
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
None
0.49A 1t7jA-4ehcA:
8.0
1t7jA-4ehcA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T7J_A_478A200_1
(POL POLYPROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 11 LEU A  34
ASP A  36
VAL A  43
GLY A  63
VAL A 115
None
ZN  A 301 (-2.3A)
None
EDO  A 319 (-3.2A)
None
0.72A 1t7jA-4ehcA:
8.0
1t7jA-4ehcA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T85_A_CAMA422_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.98A 1t85A-4ehcA:
undetectable
1t85A-4ehcA:
18.75
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.
1T87_A_CAMA1422_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.03A 1t87A-4ehcA:
undetectable
1t87A-4ehcA:
18.75
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.
1T88_B_CAMB2422_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 5 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.03A 1t88B-4ehcA:
undetectable
1t88B-4ehcA:
18.75
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.
1WG8_A_SAMA3142_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 PRO A 168
THR A 127
GLY A  41
GLY A 117
GLY A 119
None
EDO  A 306 (-4.7A)
EDO  A 306 (-3.5A)
None
None
1.23A 1wg8A-4ehcA:
undetectable
1wg8A-4ehcA:
20.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YRC_A_CAMA420_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.99A 1yrcA-4ehcA:
undetectable
1yrcA-4ehcA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YRD_A_CAMA420_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.03A 1yrdA-4ehcA:
undetectable
1yrdA-4ehcA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AKE_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 TYR A  70
THR A  61
GLY A  60
GLY A  58
THR A  74
None
1.22A 2akeA-4ehcA:
undetectable
2akeA-4ehcA:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVS_B_MK1B902_1
(POL POLYPROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 LEU A  34
ASP A  36
GLY A  38
VAL A  43
GLY A  63
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
EDO  A 319 (-3.2A)
0.78A 2avsA-4ehcA:
8.0
2avsA-4ehcA:
18.15
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.
2CPP_A_CAMA422_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.01A 2cppA-4ehcA:
undetectable
2cppA-4ehcA:
19.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FEU_A_CAMA1420_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.96A 2feuA-4ehcA:
undetectable
2feuA-4ehcA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FEU_B_CAMB1421_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.93A 2feuB-4ehcA:
undetectable
2feuB-4ehcA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 SER A 217
VAL A 174
THR A 214
ASP A 177
None
1.21A 2hdnJ-4ehcA:
2.7
2hdnK-4ehcA:
undetectable
2hdnL-4ehcA:
2.7
2hdnJ-4ehcA:
23.23
2hdnK-4ehcA:
10.00
2hdnL-4ehcA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NNP_A_ROCA401_2
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 11 LEU A  34
ASP A  36
VAL A  43
GLY A  63
VAL A 115
None
ZN  A 301 (-2.3A)
None
EDO  A 319 (-3.2A)
None
0.62A 2nnpB-4ehcA:
8.2
2nnpB-4ehcA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q0I_A_BEZA990_0
(QUINOLONE SIGNAL
RESPONSE PROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 8 ASP A 189
ASP A  36
LEU A  34
HIS A -14
ZN  A 301 (-2.0A)
ZN  A 301 (-2.3A)
None
ZN  A 301 (-3.1A)
1.07A 2q0iA-4ehcA:
undetectable
2q0iA-4ehcA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V0Z_C_C41C1328_1
(RENIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
6 / 12 ASP A  36
GLY A  38
SER A  39
VAL A 115
ASP A 189
GLY A 191
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
None
ZN  A 301 (-2.0A)
ZN  A 301 ( 3.9A)
0.36A 2v0zC-4ehcA:
5.4
2v0zC-4ehcA:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZAX_A_CAMA422_0
(CYTOCHROME P450-CAM)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.03A 2zaxA-4ehcA:
undetectable
2zaxA-4ehcA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZUH_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.09A 2zuhA-4ehcA:
undetectable
2zuhA-4ehcA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZUI_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.05A 2zuiA-4ehcA:
undetectable
2zuiA-4ehcA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZWT_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.01A 2zwtA-4ehcA:
undetectable
2zwtA-4ehcA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZWU_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.01A 2zwuA-4ehcA:
undetectable
2zwuA-4ehcA:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FWF_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.94A 3fwfA-4ehcA:
undetectable
3fwfA-4ehcA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FWF_B_CAMB420_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.92A 3fwfB-4ehcA:
undetectable
3fwfB-4ehcA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FWG_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.97A 3fwgA-4ehcA:
undetectable
3fwgA-4ehcA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FWG_B_CAMB420_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.98A 3fwgB-4ehcA:
undetectable
3fwgB-4ehcA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FWJ_A_CAMA420_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.97A 3fwjA-4ehcA:
undetectable
3fwjA-4ehcA:
19.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GGU_B_017B201_1
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 LEU A  34
ASP A  36
GLY A  38
VAL A  43
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
None
0.51A 3gguA-4ehcA:
7.8
3gguA-4ehcA:
16.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3L63_A_CAMA440_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.92A 3l63A-4ehcA:
undetectable
3l63A-4ehcA:
18.75
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.
3NU9_A_478A401_2
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 10 LEU A  34
ASP A  36
GLY A  38
VAL A  43
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
None
0.42A 3nu9B-4ehcA:
7.8
3nu9B-4ehcA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P4W_A_DSFA319_1
(GLR4197 PROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 9 PRO A 252
TYR A 228
ILE A 162
VAL A 186
ILE A 164
None
1.48A 3p4wA-4ehcA:
undetectable
3p4wA-4ehcA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3R24_A_SAMA302_0
(2'-O-METHYL
TRANSFERASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 SER A 261
LEU A 143
ASN A 156
ASP A 145
PHE A 253
EDO  A 309 ( 4.5A)
None
EDO  A 317 ( 3.3A)
None
None
1.43A 3r24A-4ehcA:
undetectable
3r24A-4ehcA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3U7S_A_017A201_1
(POL POLYPROTEIN)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 9 LEU A  34
ASP A  36
GLY A  38
GLY A  66
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
EDO  A 328 (-3.6A)
None
0.86A 3u7sA-4ehcA:
8.0
3u7sA-4ehcA:
18.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRH_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.93A 3wrhA-4ehcA:
undetectable
3wrhA-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRH_E_CAME503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.94A 3wrhE-4ehcA:
undetectable
3wrhE-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRJ_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.97A 3wrjA-4ehcA:
undetectable
3wrjA-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRJ_E_CAME503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.95A 3wrjE-4ehcA:
undetectable
3wrjE-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRL_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.94A 3wrlA-4ehcA:
undetectable
3wrlA-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRL_E_CAME503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.94A 3wrlE-4ehcA:
undetectable
3wrlE-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRM_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.94A 3wrmA-4ehcA:
undetectable
3wrmA-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WRM_F_CAMF503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.99A 3wrmF-4ehcA:
undetectable
3wrmF-4ehcA:
18.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EK1_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.91A 4ek1A-4ehcA:
undetectable
4ek1A-4ehcA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G3R_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.93A 4g3rA-4ehcA:
undetectable
4g3rA-4ehcA:
18.75
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.
4G3R_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.97A 4g3rB-4ehcA:
undetectable
4g3rB-4ehcA:
18.75
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.
4IAQ_A_2GMA2001_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 1B AND E.
COLI SOLUBLE
CYTOCHROME B562)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 ILE A 130
THR A 132
VAL A 115
ASP A 189
None
None
None
ZN  A 301 (-2.0A)
1.11A 4iaqA-4ehcA:
undetectable
4iaqA-4ehcA:
20.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L49_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 5 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.01A 4l49A-4ehcA:
undetectable
4l49A-4ehcA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L4A_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 8 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
1.00A 4l4aA-4ehcA:
undetectable
4l4aA-4ehcA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L4C_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 6 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.90A 4l4cA-4ehcA:
undetectable
4l4cA-4ehcA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L4G_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.98A 4l4gA-4ehcA:
undetectable
4l4gA-4ehcA:
19.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q5M_A_ROCA1101_1
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
6 / 12 GLY A 249
ILE A 216
VAL A 172
VAL A 210
ILE A 176
THR A 232
None
None
None
EDO  A 326 (-4.9A)
None
None
1.37A 4q5mA-4ehcA:
11.2
4q5mA-4ehcA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q5M_A_ROCA1101_3
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 ASP A  36
ASP A 189
ASN A 194
ZN  A 301 (-2.3A)
ZN  A 301 (-2.0A)
EDO  A 320 (-3.1A)
0.79A 4q5mA-4ehcA:
11.2
4q5mA-4ehcA:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QA0_A_SHHA404_1
(HISTONE DEACETYLASE
8)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 GLY A  66
HIS A -16
ASP A 189
MET A 187
GLY A 192
EDO  A 328 (-3.6A)
ZN  A 301 ( 3.2A)
ZN  A 301 (-2.0A)
None
ZN  A 301 ( 4.9A)
1.20A 4qa0A-4ehcA:
undetectable
4qa0A-4ehcA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QA2_A_SHHA404_1
(HISTONE DEACETYLASE
8)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 GLY A  66
ASP A 189
HIS A -14
ASP A  36
GLY A  38
EDO  A 328 (-3.6A)
ZN  A 301 (-2.0A)
ZN  A 301 (-3.1A)
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
1.13A 4qa2A-4ehcA:
undetectable
4qa2A-4ehcA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QA2_A_SHHA404_1
(HISTONE DEACETYLASE
8)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 GLY A  66
HIS A -16
ASP A 189
MET A 187
GLY A 192
EDO  A 328 (-3.6A)
ZN  A 301 ( 3.2A)
ZN  A 301 (-2.0A)
None
ZN  A 301 ( 4.9A)
1.13A 4qa2A-4ehcA:
undetectable
4qa2A-4ehcA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QA2_B_SHHB404_1
(HISTONE DEACETYLASE
8)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 GLY A  66
HIS A -16
ASP A 189
MET A 187
GLY A 192
EDO  A 328 (-3.6A)
ZN  A 301 ( 3.2A)
ZN  A 301 (-2.0A)
None
ZN  A 301 ( 4.9A)
1.16A 4qa2B-4ehcA:
undetectable
4qa2B-4ehcA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z90_E_4LEE401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 THR A 157
LEU A 158
LEU A 143
THR A   8
None
EDO  A 317 (-4.0A)
None
EDO  A 321 ( 3.2A)
0.79A 4z90A-4ehcA:
undetectable
4z90B-4ehcA:
undetectable
4z90C-4ehcA:
undetectable
4z90D-4ehcA:
undetectable
4z90E-4ehcA:
undetectable
4z90A-4ehcA:
21.94
4z90B-4ehcA:
21.94
4z90C-4ehcA:
21.94
4z90D-4ehcA:
21.94
4z90E-4ehcA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z90_F_4LEF401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 8 THR A   8
THR A 157
LEU A 158
LEU A 143
EDO  A 321 ( 3.2A)
None
EDO  A 317 (-4.0A)
None
0.75A 4z90F-4ehcA:
undetectable
4z90G-4ehcA:
undetectable
4z90H-4ehcA:
undetectable
4z90I-4ehcA:
undetectable
4z90J-4ehcA:
undetectable
4z90F-4ehcA:
21.94
4z90G-4ehcA:
21.94
4z90H-4ehcA:
21.94
4z90I-4ehcA:
21.94
4z90J-4ehcA:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GWZ_D_010D6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
PEDV MAIN PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 MET A 187
HIS A -16
GLY A 119
None
ZN  A 301 ( 3.2A)
None
0.80A 5gwzB-4ehcA:
1.7
5gwzB-4ehcA:
25.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LBT_A_6T0A303_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 10 PHE A  48
ILE A  23
PHE A  53
GLY A  28
GLY A  27
None
None
EDO  A 308 (-4.1A)
EDO  A 303 (-3.4A)
None
1.34A 5lbtA-4ehcA:
undetectable
5lbtB-4ehcA:
undetectable
5lbtA-4ehcA:
22.08
5lbtB-4ehcA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_A_CUA602_0
(THIOCYANATE
DEHYDROGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 LYS A -21
HIS A -17
HIS A -18
None
EDO  A 307 (-3.7A)
None
1.15A 5oexA-4ehcA:
undetectable
5oexA-4ehcA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_B_CUB602_0
(THIOCYANATE
DEHYDROGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 LYS A -21
HIS A -17
HIS A -18
None
EDO  A 307 (-3.7A)
None
1.08A 5oexB-4ehcA:
undetectable
5oexB-4ehcA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_C_CUC603_0
(THIOCYANATE
DEHYDROGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 LYS A -21
HIS A -17
HIS A -18
None
EDO  A 307 (-3.7A)
None
1.09A 5oexC-4ehcA:
undetectable
5oexC-4ehcA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OEX_D_CUD603_0
(THIOCYANATE
DEHYDROGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
3 / 3 LYS A -21
HIS A -17
HIS A -18
None
EDO  A 307 (-3.7A)
None
1.13A 5oexD-4ehcA:
undetectable
5oexD-4ehcA:
21.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WK9_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
4 / 7 PHE A 153
LEU A  35
VAL A  21
VAL A  79
None
0.88A 5wk9A-4ehcA:
undetectable
5wk9A-4ehcA:
18.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DH0_A_017A101_0
(PROTEASE)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 12 LEU A  34
ASP A  36
GLY A  38
VAL A  43
VAL A 115
None
ZN  A 301 (-2.3A)
ZN  A 301 ( 3.9A)
None
None
0.52A 6dh0A-4ehcA:
8.2
6dh0A-4ehcA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EU9_B_REAB601_1
(RETINOIC ACID
RECEPTOR)
4ehc PE-PGRS FAMILY
PROTEIN

(Mycobacterium
tuberculosis)
5 / 10 LEU A 107
SER A 108
PHE A 106
GLY A 192
GLY A -10
EDO  A 327 ( 4.7A)
None
EDO  A 327 (-3.3A)
ZN  A 301 ( 4.9A)
EDO  A 315 (-4.4A)
1.19A 6eu9B-4ehcA:
undetectable
6eu9B-4ehcA:
13.21