SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1x8v'

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.
1EA1_A_TPFA470_1
(CYTOCHROME P450
51-LIKE RV0764C)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 PHE A  78
MET A  79
ARG A  96
PHE A 255
 ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
ESL  A 471 (-3.6A)
None
 0.80A 1ea1A-1x8vA:
61.2		 1ea1A-1x8vA:
99.56
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1EA1_A_TPFA470_1
(CYTOCHROME P450
51-LIKE RV0764C)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 8 TYR A  76
PHE A  78
MET A  79
PHE A 255
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.52A 1ea1A-1x8vA:
61.2		 1ea1A-1x8vA:
99.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DTJ_A_THRA401_0
(ASPARTOKINASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 GLY A 330
GLU A 341
ALA A 328
ILE A 339
 None
 0.82A 2dtjA-1x8vA:
undetectable
2dtjB-1x8vA:
undetectable		 2dtjA-1x8vA:
17.61
2dtjB-1x8vA:
17.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2H77_A_T3A1_1
(THRA PROTEIN)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 ALA A  75
ALA A 328
LEU A  70
LEU A  53
ILE A 339
 None
 1.11A 2h77A-1x8vA:
2.8		 2h77A-1x8vA:
21.37
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.
2N27_A_4DYA205_1
(CALMODULIN)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 11 LEU A 161
ILE A 153
LEU A 411
VAL A 121
MET A 124
 None
 1.28A 2n27A-1x8vA:
0.0		 2n27A-1x8vA:
15.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NV4_A_ACTA148_0
(UPF0066 PROTEIN
AF_0241)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 VAL A 310
GLU A 271
GLU A 313
 None
 0.63A 2nv4A-1x8vA:
undetectable		 2nv4A-1x8vA:
15.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WUZ_A_TPFA1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE
, PUTATIVE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 10 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.06A 2wuzA-1x8vA:
39.7		 2wuzA-1x8vA:
32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WUZ_B_TPFB1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE
, PUTATIVE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 10 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.07A 2wuzB-1x8vA:
39.6		 2wuzB-1x8vA:
32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2WX2_A_TPFA1460_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 7 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.95A 2wx2A-1x8vA:
37.9		 2wx2A-1x8vA:
32.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
MET A  79
ALA A 256
THR A 260
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
None
 1.04A 2x2nA-1x8vA:
37.7		 2x2nA-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
MET A  79
PHE A  83
ALA A 256
THR A 260
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
 1.24A 2x2nA-1x8vA:
37.7		 2x2nA-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
PHE A  78
MET A  79
ALA A 256
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
ESL  A 471 ( 3.4A)
None
 1.08A 2x2nA-1x8vA:
37.7		 2x2nA-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_A_X2NA1480_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
PHE A  78
MET A  79
PHE A  83
ALA A 256
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
 1.25A 2x2nA-1x8vA:
37.7		 2x2nA-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_B_X2NB1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 12 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
MET A 325
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
None
 1.07A 2x2nB-1x8vA:
38.1		 2x2nB-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_B_X2NB1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 12 PHE A  78
MET A  79
PHE A  83
ALA A 256
LEU A 321
MET A 325
 ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-4.1A)
None
 1.07A 2x2nB-1x8vA:
38.1		 2x2nB-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_C_X2NC1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 12 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
MET A 325
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
None
 1.13A 2x2nC-1x8vA:
38.5		 2x2nC-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_C_X2NC1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 12 PHE A  78
MET A  79
PHE A  83
ALA A 256
LEU A 321
MET A 325
 ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-4.1A)
None
 1.14A 2x2nC-1x8vA:
38.5		 2x2nC-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_D_X2ND1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		7 / 12 TYR A  76
MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
None
 1.19A 2x2nD-1x8vA:
37.9		 2x2nD-1x8vA:
31.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2X2N_D_X2ND1479_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		7 / 12 TYR A  76
PHE A  78
MET A  79
PHE A  83
ALA A 256
LEU A 321
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-4.1A)
None
 1.22A 2x2nD-1x8vA:
37.9		 2x2nD-1x8vA:
31.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E4E_A_4PZA501_1
(CYTOCHROME P450 2E1)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 256
THR A 260
CYH A 394
 ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-2.4A)
 0.52A 3e4eA-1x8vA:
31.5		 3e4eA-1x8vA:
23.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E4E_B_4PZB501_1
(CYTOCHROME P450 2E1)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 256
THR A 260
CYH A 394
 ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-2.4A)
 0.42A 3e4eB-1x8vA:
31.6		 3e4eB-1x8vA:
23.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3KHM_A_TPFA501_1
(STEROL 14
ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 8 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.97A 3khmA-1x8vA:
38.0		 3khmA-1x8vA:
32.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KK6_B_CELB1701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 6 SER A 148
LEU A 204
ILE A 153
ALA A 166
 None
 0.91A 3kk6B-1x8vA:
undetectable		 3kk6B-1x8vA:
19.76
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3L4D_A_TPFA490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 TYR A  76
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.75A 3l4dA-1x8vA:
38.6		 3l4dA-1x8vA:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3L4D_B_TPFB490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 9 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.04A 3l4dB-1x8vA:
38.6		 3l4dB-1x8vA:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3L4D_C_TPFC490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 9 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.05A 3l4dC-1x8vA:
38.6		 3l4dC-1x8vA:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3L4D_D_TPFD490_1
(STEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 8 MET A  79
PHE A  83
ALA A 256
THR A 260
LEU A 321
 ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.04A 3l4dD-1x8vA:
38.7		 3l4dD-1x8vA:
32.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3LD6_A_KKKA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 PHE A  83
ALA A 256
THR A 260
ILE A 323
MET A 325
 None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
None
None
 0.99A 3ld6A-1x8vA:
41.5		 3ld6A-1x8vA:
34.32
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3LD6_A_KKKA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
PHE A  83
THR A 260
ILE A 323
MET A 325
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
None
None
 0.99A 3ld6A-1x8vA:
41.5		 3ld6A-1x8vA:
34.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_A_CELA682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 8 SER A 148
LEU A 204
ARG A 158
ILE A 153
PHE A 157
 None
 1.33A 3ln1A-1x8vA:
0.0		 3ln1A-1x8vA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_B_CELB682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 7 SER A 148
LEU A 204
ARG A 158
ILE A 153
PHE A 157
 None
 1.34A 3ln1B-1x8vA:
0.5		 3ln1B-1x8vA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3LN1_C_CELC682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 7 SER A 148
LEU A 204
ARG A 158
ILE A 153
PHE A 157
 None
 1.33A 3ln1C-1x8vA:
2.0		 3ln1C-1x8vA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NXU_B_RITB600_1
(CYTOCHROME P450 3A4)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 MET A 433
PHE A  78
ILE A 323
ALA A 346
ALA A 389
 ESL  A 471 (-4.7A)
ESL  A 471 ( 4.9A)
None
None
None
 1.14A 3nxuB-1x8vA:
34.5		 3nxuB-1x8vA:
25.39
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.
3SUE_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 GLN A  31
ARG A 326
SER A  54
ALA A 347
ALA A 346
 None
HEM  A 470 (-2.9A)
None
None
None
 1.16A 3sueB-1x8vA:
undetectable		 3sueB-1x8vA:
18.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3S_C_9PLC1_1
(CYTOCHROME P450 2A13)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 7 PHE A 255
ALA A 256
THR A 260
LEU A 321
 None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.61A 3t3sC-1x8vA:
31.8		 3t3sC-1x8vA:
25.51
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.
4CD2_A_FOLA207_0
(DIHYDROFOLATE
REDUCTASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 304
ALA A 300
ILE A 404
LEU A 272
TYR A 290
 None
 1.22A 4cd2A-1x8vA:
undetectable		 4cd2A-1x8vA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LNW_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 ALA A  75
ALA A 328
LEU A  70
LEU A  53
ILE A 339
 None
 1.10A 4lnwA-1x8vA:
undetectable		 4lnwA-1x8vA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LNX_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 ALA A  75
ALA A 328
LEU A  70
LEU A  53
ILE A 339
 None
 1.09A 4lnxA-1x8vA:
undetectable		 4lnxA-1x8vA:
20.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MI4_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 7 GLU A 376
TYR A 370
GLU A 371
ARG A 369
 None
 1.17A 4mi4B-1x8vA:
undetectable
4mi4C-1x8vA:
undetectable		 4mi4B-1x8vA:
18.94
4mi4C-1x8vA:
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.
4MJ8_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 GLU A 376
TYR A 370
GLU A 371
ARG A 369
 None
 1.17A 4mj8B-1x8vA:
undetectable
4mj8C-1x8vA:
undetectable		 4mj8B-1x8vA:
16.96
4mj8C-1x8vA:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE0_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 9 TYR A  76
PHE A  83
THR A 260
LEU A 321
LEU A 324
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
HEM  A 470 ( 3.9A)
 0.88A 4ze0A-1x8vA:
34.4		 4ze0A-1x8vA:
28.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE3_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 7 TYR A  76
PHE A  83
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.93A 4ze3A-1x8vA:
35.3		 4ze3A-1x8vA:
28.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DZK_R_BEZR801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 7 PHE A 139
SER A 262
HIS A 258
LEU A 137
 None
 0.86A 5dzkD-1x8vA:
undetectable
5dzkR-1x8vA:
undetectable		 5dzkD-1x8vA:
17.98
5dzkR-1x8vA:
3.77
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.
5ESE_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 TYR A  76
PHE A  83
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.90A 5eseA-1x8vA:
35.6		 5eseA-1x8vA:
28.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ESF_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 TYR A  76
PHE A  83
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.90A 5esfA-1x8vA:
35.3		 5esfA-1x8vA:
28.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ESH_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 LEU A  19
TYR A  76
PHE A  83
THR A 260
LEU A 321
 None
ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 1.04A 5eshA-1x8vA:
34.7		 5eshA-1x8vA:
28.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ESM_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 7 TYR A  76
PHE A  83
THR A 260
LEU A 321
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
 0.90A 5esmA-1x8vA:
35.2		 5esmA-1x8vA:
28.42
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FSA_B_X2NB590_2
(CYP51 VARIANT1)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 PRO A 178
LEU A  29
SER A 431
 None
 0.77A 5fsaB-1x8vA:
34.6		 5fsaB-1x8vA:
30.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HS1_A_VORA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 8 TYR A  76
PHE A  83
THR A 260
LEU A 321
LEU A 324
 ESL  A 471 ( 3.8A)
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
HEM  A 470 ( 3.9A)
 0.91A 5hs1A-1x8vA:
35.5		 5hs1A-1x8vA:
27.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IAO_C_URFC301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ARG A 316
HIS A 318
ARG A 354
 None
 1.01A 5iaoC-1x8vA:
undetectable		 5iaoC-1x8vA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ARG A 316
HIS A 318
ARG A 354
 None
 0.99A 5iaoF-1x8vA:
undetectable		 5iaoF-1x8vA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEO_A_VDYA206_2
(CDL2.3A)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		4 / 8 ILE A 117
LEU A 307
ILE A 304
LEU A 143
 None
 0.98A 5ieoA-1x8vA:
undetectable		 5ieoA-1x8vA:
14.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KIR_A_RCXA601_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ARG A 158
ILE A 153
PHE A 157
 None
 0.62A 5kirA-1x8vA:
undetectable		 5kirA-1x8vA:
21.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AY4_A_TPFA506_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		7 / 10 MET A  79
PHE A  83
PHE A 255
ALA A 256
THR A 260
LEU A 321
CYH A 394
 ESL  A 471 ( 4.4A)
None
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
HEM  A 470 (-2.4A)
 1.03A 6ay4A-1x8vA:
41.4		 6ay4A-1x8vA:
32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AY4_A_TPFA506_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		7 / 10 TYR A  76
MET A  79
PHE A  83
PHE A 255
THR A 260
LEU A 321
CYH A 394
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
None
None
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
HEM  A 470 (-2.4A)
 0.90A 6ay4A-1x8vA:
41.4		 6ay4A-1x8vA:
32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AY4_A_TPFA506_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 10 TYR A  76
PHE A 255
ALA A 256
THR A 260
CYH A 394
 ESL  A 471 ( 3.8A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-2.4A)
 1.15A 6ay4A-1x8vA:
41.4		 6ay4A-1x8vA:
32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AY6_A_VORA501_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 9 TYR A  76
PHE A  83
ALA A 256
THR A 260
LEU A 321
CYH A 394
 ESL  A 471 ( 3.8A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
HEM  A 470 (-2.4A)
 0.94A 6ay6A-1x8vA:
41.4		 6ay6A-1x8vA:
32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
PHE A  78
LEU A 321
ILE A 322
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
HEM  A 470 (-4.1A)
None
None
 1.15A 6aybA-1x8vA:
41.6		 6aybA-1x8vA:
32.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6AYB_A_KKKA508_1
(CYP51, STEROL
14ALPHA-DEMETHYLASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
THR A 260
LEU A 321
ILE A 322
MET A 325
 ESL  A 471 ( 3.8A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
None
None
 0.88A 6aybA-1x8vA:
41.6		 6aybA-1x8vA:
32.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		6 / 12 TYR A  76
MET A  79
ALA A 256
THR A 260
LEU A 321
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
HEM  A 470 (-4.1A)
None
 0.97A 6aycA-1x8vA:
42.0		 6aycA-1x8vA:
9.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
MET A  79
PHE A  83
ALA A 256
THR A 260
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.4A)
None
ESL  A 471 ( 3.4A)
HEM  A 470 (-3.6A)
 0.94A 6aycA-1x8vA:
42.0		 6aycA-1x8vA:
9.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 TYR A  76
PHE A  78
MET A  79
LEU A 321
MET A 325
 ESL  A 471 ( 3.8A)
ESL  A 471 ( 4.9A)
ESL  A 471 ( 4.4A)
HEM  A 470 (-4.1A)
None
 1.07A 6aycA-1x8vA:
42.0		 6aycA-1x8vA:
9.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DWN_B_AQ4B602_0
(CYTOCHROME P450 1A1)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 153
PHE A 250
LEU A 100
ASP A 224
ILE A 208
 None
 1.38A 6dwnB-1x8vA:
31.5		 6dwnB-1x8vA:
11.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		5 / 11 ALA A 346
LEU A  53
VAL A  51
VAL A 334
ALA A  65
 None
 1.24A 6h1lB-1x8vA:
31.1		 6h1lB-1x8vA:
25.94
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.
6MXT_A_K5YA1401_1
(ENDOLYSIN, BETA-2
ADRENERGIC RECEPTOR
CHIMERA)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 135
SER A 262
SER A 266
 None
 0.83A 6mxtA-1x8vA:
undetectable		 6mxtA-1x8vA:
21.87
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.
6MXT_A_K5YA1401_1
(ENDOLYSIN, BETA-2
ADRENERGIC RECEPTOR
CHIMERA)		 1x8v CYTOCHROME P450 51
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 138
SER A 262
SER A 266
 None
 0.68A 6mxtA-1x8vA:
undetectable		 6mxtA-1x8vA:
21.87