SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2xn8'

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.
1Q13_A_TESA501_1
(PROSTAGLANDIN-E2
9-REDUCTASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 6 TYR A 208
GLU A 408
PRO A 407
VAL A 167
 None
 1.34A 1q13A-2xn8A:
undetectable		 1q13A-2xn8A:
22.60
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.
1TT6_B_DESB128_1
(TRANSTHYRETIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 5 LEU A 243
ALA A 228
LEU A 253
SER A 254
 None
 1.06A 1tt6B-2xn8A:
undetectable		 1tt6B-2xn8A:
16.08
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.
1X8V_A_ESLA471_1
(CYTOCHROME P450 51)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 8 TYR A 294
PHE A 284
ALA A 303
MET A 281
 None
 1.16A 1x8vA-2xn8A:
27.6		 1x8vA-2xn8A:
26.08
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.
2PXC_A_SAMA500_0
(GENOME POLYPROTEIN
[CONTAINS: CAPSID
PROTEIN C (CORE
PROTEIN)
ENVELOPE PROTEIN M
(MATRIX PROTEIN)
MAJOR ENVELOPE
PROTEIN E
NON-STRUCTURAL
PROTEIN 1 (NS1)
NON-STRUCTURAL
PROTEIN 2A (NS2A)
FLAVIVIRIN PROTEASE
NS2B REGULATORY
SUBUNIT
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT
NON-STRUCTURAL
PROTEIN 4A (NS4A)
NON-STRUCTURAL
PROTEIN 4B (NS4B)
RNA-DIRECTED RNA
POLYMERASE (EC
2.7.7.48) (NS5)])		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.78A 2pxcA-2xn8A:
undetectable		 2pxcA-2xn8A:
22.72
Potential target for repurposing, i.e. matched protein structure has less than 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)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 268
THR A 272
CYH A 377
 HEM  A1434 (-3.5A)
HEM  A1434 (-3.8A)
HEM  A1434 (-2.3A)
 0.56A 3e4eA-2xn8A:
27.1		 3e4eA-2xn8A:
25.00
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.
3E4E_B_4PZB501_1
(CYTOCHROME P450 2E1)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		3 / 3 ALA A 268
THR A 272
CYH A 377
 HEM  A1434 (-3.5A)
HEM  A1434 (-3.8A)
HEM  A1434 (-2.3A)
 0.52A 3e4eB-2xn8A:
27.7		 3e4eB-2xn8A:
25.00
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.
3ELU_A_SAMA4633_0
(METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  68
ASP A  58
 None
 1.05A 3eluA-2xn8A:
undetectable		 3eluA-2xn8A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELW_A_SAMA4633_0
(METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.90A 3elwA-2xn8A:
undetectable		 3elwA-2xn8A:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GCZ_A_SAMA4633_0
(POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  68
ASP A  58
 None
 1.03A 3gczA-2xn8A:
undetectable		 3gczA-2xn8A:
23.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IW1_A_ASDA1223_1
(CYTOCHROME P450
CYP125)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		8 / 12 ILE A  97
VAL A 111
GLN A 112
PHE A 114
VAL A 115
SER A 217
ILE A 221
VAL A 267
 None
 1.10A 3iw1A-2xn8A:
68.5		 3iw1A-2xn8A:
96.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3IW1_A_ASDA1223_1
(CYTOCHROME P450
CYP125)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		10 / 12 ILE A  97
VAL A 111
PHE A 114
VAL A 115
MET A 200
PRO A 213
SER A 217
ILE A 221
VAL A 263
VAL A 267
 None
 0.82A 3iw1A-2xn8A:
68.5		 3iw1A-2xn8A:
96.07
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.
3NDI_A_SAMA601_0
(METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 PHE A 166
GLU A 157
ILE A 154
ALA A 156
ILE A 390
 None
 1.33A 3ndiA-2xn8A:
undetectable		 3ndiA-2xn8A:
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.
3NT1_A_NPSA5_1
(PROSTAGLANDIN-ENDOPE
ROXIDE SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.01A 3nt1A-2xn8A:
0.7		 3nt1A-2xn8A:
22.09
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.
3NT1_B_NPSB4_1
(PROSTAGLANDIN-ENDOPE
ROXIDE SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.02A 3nt1B-2xn8A:
undetectable		 3nt1B-2xn8A:
22.09
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.
3OHT_B_1N1B2000_1
(P38A)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 10 ARG A 308
ILE A  73
ILE A  52
ASN A  77
VAL A 350
 None
 1.39A 3ohtA-2xn8A:
0.4
3ohtB-2xn8A:
undetectable		 3ohtA-2xn8A:
22.59
3ohtB-2xn8A:
22.59
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.
3P97_A_SAMA263_0
(NON-STRUCTURAL
PROTEIN 5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 3p97A-2xn8A:
undetectable		 3p97A-2xn8A:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P97_C_SAMC263_0
(NON-STRUCTURAL
PROTEIN 5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 3p97C-2xn8A:
undetectable		 3p97C-2xn8A:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3PGH_B_FLPB701_1
(CYCLOOXYGENASE-2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 11 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.97A 3pghB-2xn8A:
undetectable		 3pghB-2xn8A:
22.09
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.
3PGH_C_FLPC701_1
(CYCLOOXYGENASE-2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.98A 3pghC-2xn8A:
0.8		 3pghC-2xn8A:
22.09
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.
3PGH_D_FLPD701_1
(CYCLOOXYGENASE-2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.98A 3pghD-2xn8A:
undetectable		 3pghD-2xn8A:
22.09
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.
3UJ7_A_SAMA301_1
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		3 / 3 SER A 217
ASP A 108
ASP A 103
 None
 0.90A 3uj7A-2xn8A:
undetectable		 3uj7A-2xn8A:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 8 GLN A  57
PHE A  65
GLY A  62
GLY A 334
 None
 0.85A 3v3nB-2xn8A:
undetectable		 3v3nB-2xn8A:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AE1_A_NCAA1536_0
(DIPHTHERIA TOXIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 6 GLY A 222
ALA A 224
TYR A 223
GLU A 230
 None
 0.87A 4ae1A-2xn8A:
undetectable		 4ae1A-2xn8A:
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.
4COX_C_IMNC701_1
(CYCLOOXYGENASE-2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 4coxC-2xn8A:
undetectable		 4coxC-2xn8A:
22.09
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.
4CTJ_A_SAMA1263_0
(NON-STRUCTURAL
PROTEIN 5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 4ctjA-2xn8A:
undetectable		 4ctjA-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTJ_C_SAMC1263_0
(NON-STRUCTURAL
PROTEIN 5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 4ctjC-2xn8A:
undetectable		 4ctjC-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTK_A_SAMA1263_0
(POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 4ctkA-2xn8A:
undetectable		 4ctkA-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CTK_C_SAMC1263_0
(POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.73A 4ctkC-2xn8A:
undetectable		 4ctkC-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DUB_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 9D7)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 6 PHE A 258
ALA A 224
LEU A 183
VAL A 185
 None
 1.00A 4dubA-2xn8A:
29.2		 4dubA-2xn8A:
22.73
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.
4FOG_D_C2FD302_0
(THYMIDYLATE SYNTHASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 11 ILE A 179
LEU A 243
LEU A 382
GLY A 379
ALA A 139
 None
None
HEM  A1434 ( 4.9A)
HEM  A1434 (-3.6A)
None
 1.10A 4fogD-2xn8A:
undetectable		 4fogD-2xn8A:
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.
4OTY_A_LURA705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.02A 4otyA-2xn8A:
0.7		 4otyA-2xn8A:
22.09
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.
4OTY_B_LURB705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.99A 4otyB-2xn8A:
undetectable		 4otyB-2xn8A:
22.09
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.
4RRW_A_LURA705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.04A 4rrwA-2xn8A:
undetectable		 4rrwA-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRW_C_LURC705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 4rrwC-2xn8A:
undetectable		 4rrwC-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRW_D_LURD705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 4rrwD-2xn8A:
undetectable		 4rrwD-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRX_A_LURA706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.97A 4rrxA-2xn8A:
undetectable		 4rrxA-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRX_B_LURB706_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.97A 4rrxB-2xn8A:
undetectable		 4rrxB-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_A_LURA705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.04A 4rrzA-2xn8A:
undetectable		 4rrzA-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_C_LURC705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 4rrzC-2xn8A:
undetectable		 4rrzC-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_D_LURD705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 4rrzD-2xn8A:
undetectable		 4rrzD-2xn8A:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E9Q_A_SAMA301_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5e9qA-2xn8A:
undetectable		 5e9qA-2xn8A:
22.00
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.
5E9Q_C_SAMC4000_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 5e9qC-2xn8A:
undetectable		 5e9qC-2xn8A:
22.00
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.
5EC8_A_SAMA301_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5ec8A-2xn8A:
undetectable		 5ec8A-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EC8_C_SAMC4000_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5ec8C-2xn8A:
undetectable		 5ec8C-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EHG_A_SAMA301_0
(RNA-DIRECTED RNA
POLYMERASE NS5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.72A 5ehgA-2xn8A:
undetectable		 5ehgA-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EHG_C_SAMC4001_0
(RNA-DIRECTED RNA
POLYMERASE NS5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.72A 5ehgC-2xn8A:
undetectable		 5ehgC-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EIF_A_SAMA301_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5eifA-2xn8A:
undetectable		 5eifA-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EIF_C_SAMC4000_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 5eifC-2xn8A:
undetectable		 5eifC-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EIW_C_SAMC4000_0
(NS5
METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5eiwC-2xn8A:
undetectable		 5eiwC-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EKX_B_SAMB4000_0
(NS5
METHYLTRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 5ekxB-2xn8A:
undetectable		 5ekxB-2xn8A:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKM_A_SAMA311_0
(NS5 METHYL
TRANSFERASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.79A 5ikmA-2xn8A:
undetectable		 5ikmA-2xn8A:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKQ_A_JMSA602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 0.99A 5ikqA-2xn8A:
undetectable		 5ikqA-2xn8A:
20.00
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.
5IKQ_B_JMSB602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.01A 5ikqB-2xn8A:
undetectable		 5ikqB-2xn8A:
20.00
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.
5IKR_A_ID8A601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 5ikrA-2xn8A:
0.0		 5ikrA-2xn8A:
20.00
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.
5IKR_B_ID8B602_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.01A 5ikrB-2xn8A:
undetectable		 5ikrB-2xn8A:
20.00
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.
5JVZ_A_FLPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.01A 5jvzA-2xn8A:
undetectable		 5jvzA-2xn8A:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KIR_A_RCXA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 313
LEU A 415
VAL A 267
GLY A 269
ALA A 268
 HEM  A1434 ( 4.9A)
None
None
HEM  A1434 (-3.3A)
HEM  A1434 (-3.5A)
 1.05A 5kirA-2xn8A:
undetectable		 5kirA-2xn8A:
19.96
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.
5KQS_A_SAMA307_0
(GENOME POLYPROTEIN)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.75A 5kqsA-2xn8A:
undetectable		 5kqsA-2xn8A:
20.56
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.
5NJV_A_SAMA301_0
(NS5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.73A 5njvA-2xn8A:
undetectable		 5njvA-2xn8A:
20.37
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.
5NJV_B_SAMB301_0
(NS5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.72A 5njvB-2xn8A:
undetectable		 5njvB-2xn8A:
20.37
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.
5NJV_C_SAMC301_0
(NS5)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.74A 5njvC-2xn8A:
undetectable		 5njvC-2xn8A:
20.37
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.
5WZ2_A_SAMA601_0
(NS5 MTASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.71A 5wz2A-2xn8A:
undetectable		 5wz2A-2xn8A:
21.56
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.
5WZ2_B_SAMB601_0
(NS5 MTASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.71A 5wz2B-2xn8A:
undetectable		 5wz2B-2xn8A:
21.56
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.
5WZ2_C_SAMC601_0
(NS5 MTASE)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  56
GLY A  60
GLY A  62
GLY A  69
ASP A  58
 None
 0.73A 5wz2C-2xn8A:
undetectable		 5wz2C-2xn8A:
21.56
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.
6CDU_A_EY4A501_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 5 GLN A 317
VAL A 337
PRO A  98
THR A  74
 None
 1.44A 6cduA-2xn8A:
1.5
6cduB-2xn8A:
1.3		 6cduA-2xn8A:
21.00
6cduB-2xn8A:
21.00
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.
6DWD_A_GLYA715_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 2xn8 PUTATIVE CYTOCHROME
P450 125
(Mycobacterium
tuberculosis) 		4 / 6 GLY A  95
ASN A  94
SER A  90
ARG A 318
 None
None
None
HEM  A1434 (-3.0A)
 1.12A 6dwdA-2xn8A:
undetectable
6dwdC-2xn8A:
undetectable		 6dwdA-2xn8A:
22.34
6dwdC-2xn8A:
22.34