SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2hi4'

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.
1HRK_B_CHDB2501_0
(FERROCHELATASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.21A 1hrkB-2hi4A:
undetectable		 1hrkB-2hi4A:
21.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1NR6_A_DIFA501_1
(CYTOCHROME P450 2C5)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 9 PHE A 125
GLY A 316
ALA A 317
THR A 321
LEU A 382
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.70A 1nr6A-2hi4A:
42.6		 1nr6A-2hi4A:
31.71
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.
2B82_A_ADNA1001_1
(CLASS B ACID
PHOSPHATASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 10 PHE A 125
LEU A 497
GLY A 316
ASP A 320
THR A 113
 None
BHF  A 800 (-4.4A)
BHF  A 800 (-3.8A)
BHF  A 800 (-4.0A)
None
 1.48A 2b82A-2hi4A:
undetectable		 2b82A-2hi4A:
18.54
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.
2PNJ_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 365
LEU A 368
PHE A 469
ILE A 351
VAL A 192
 None
 1.12A 2pnjA-2hi4A:
undetectable		 2pnjA-2hi4A:
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.
2PO5_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.18A 2po5A-2hi4A:
undetectable		 2po5A-2hi4A:
21.59
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.
2PO7_A_CHDA501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.12A 2po7A-2hi4A:
undetectable		 2po7A-2hi4A:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB501_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.13A 2po7B-2hi4A:
undetectable		 2po7B-2hi4A:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3APX_A_Z80A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 VAL A 220
THR A 323
PHE A 471
LEU A 161
ALA A 202
 None
 1.48A 3apxA-2hi4A:
undetectable		 3apxA-2hi4A:
17.37
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.
3AQI_B_CHDB6_0
(FERROCHELATASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.22A 3aqiB-2hi4A:
undetectable		 3aqiB-2hi4A:
21.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3E4E_A_4PZA501_1
(CYTOCHROME P450 2E1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 ALA A 317
THR A 321
CYH A 458
 HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-2.3A)
 0.51A 3e4eA-2hi4A:
43.3		 3e4eA-2hi4A:
32.07
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3E4E_B_4PZB501_1
(CYTOCHROME P450 2E1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 ALA A 317
THR A 321
CYH A 458
 HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-2.3A)
 0.42A 3e4eB-2hi4A:
43.2		 3e4eB-2hi4A:
32.07
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.
3FWG_B_CAMB420_0
(CAMPHOR
5-MONOOXYGENASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 7 PHE A 209
LEU A 217
VAL A 220
THR A 323
 None
 0.95A 3fwgB-2hi4A:
29.2		 3fwgB-2hi4A:
21.71
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.
3HS4_A_AZMA702_1
(CARBONIC ANHYDRASE 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 7 LYS A 342
TYR A 367
GLU A 374
PRO A 429
 None
 1.18A 3hs4A-2hi4A:
undetectable		 3hs4A-2hi4A:
19.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_E_TFPE201_1
(PROTEIN S100-A4)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 7 PHE A 319
GLY A 316
PHE A 315
PHE A 209
 None
BHF  A 800 (-3.8A)
None
None
 0.99A 3ko0D-2hi4A:
undetectable
3ko0E-2hi4A:
undetectable		 3ko0D-2hi4A:
12.50
3ko0E-2hi4A:
12.50
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.
3KO0_O_TFPO201_1
(PROTEIN S100-A4)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 8 PHE A 209
PHE A 319
GLY A 316
PHE A 315
 None
None
BHF  A 800 (-3.8A)
None
 1.00A 3ko0O-2hi4A:
undetectable
3ko0Q-2hi4A:
undetectable		 3ko0O-2hi4A:
12.50
3ko0Q-2hi4A:
12.50
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.
3LN1_A_CELA682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 8 LEU A 497
SER A 231
LEU A 450
ILE A 386
 BHF  A 800 (-4.4A)
None
HEM  A 900 (-4.0A)
HEM  A 900 (-4.0A)
 0.69A 3ln1A-2hi4A:
0.0		 3ln1A-2hi4A:
22.40
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.
3LN1_B_CELB682_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 7 LEU A 497
SER A 231
LEU A 450
ILE A 386
 BHF  A 800 (-4.4A)
None
HEM  A 900 (-4.0A)
HEM  A 900 (-4.0A)
 0.67A 3ln1B-2hi4A:
0.0		 3ln1B-2hi4A:
22.40
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.
3M0W_H_P77H203_1
(PROTEIN S100-A4)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 10 LEU A 368
SER A 329
ILE A 343
PHE A 427
SER A 379
 None
 1.25A 3m0wE-2hi4A:
0.0
3m0wF-2hi4A:
undetectable
3m0wG-2hi4A:
undetectable
3m0wH-2hi4A:
undetectable		 3m0wE-2hi4A:
11.45
3m0wF-2hi4A:
11.45
3m0wG-2hi4A:
11.45
3m0wH-2hi4A:
11.45
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.
3M0W_H_P77H203_1
(PROTEIN S100-A4)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 10 LEU A 368
SER A 329
ILE A 343
PHE A 432
PHE A 427
 None
 1.46A 3m0wE-2hi4A:
0.0
3m0wF-2hi4A:
undetectable
3m0wG-2hi4A:
undetectable
3m0wH-2hi4A:
undetectable		 3m0wE-2hi4A:
11.45
3m0wF-2hi4A:
11.45
3m0wG-2hi4A:
11.45
3m0wH-2hi4A:
11.45
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.
3QX3_D_EVPD1_1
(DNA TOPOISOMERASE
2-BETA)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 5 GLY A 285
ASP A 282
ARG A 281
GLN A 273
 None
 1.29A 3qx3B-2hi4A:
1.0		 3qx3B-2hi4A:
19.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3RUK_A_AERA601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 125
ASP A 313
ALA A 317
THR A 321
CYH A 458
 None
BHF  A 800 (-3.9A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-2.3A)
 0.75A 3rukA-2hi4A:
41.7		 3rukA-2hi4A:
32.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3RUK_D_AERD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 11 PHE A 125
ASP A 313
GLY A 316
ALA A 317
THR A 321
 None
BHF  A 800 (-3.9A)
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
 0.72A 3rukD-2hi4A:
40.9		 3rukD-2hi4A:
32.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3UA5_A_06XA501_1
(CYTOCHROME P450 2B6)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 8 ILE A 339
PHE A 427
GLU A 369
LEU A 433
 None
 0.81A 3ua5A-2hi4A:
40.1		 3ua5A-2hi4A:
32.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W1W_A_CHDA1502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.20A 3w1wA-2hi4A:
undetectable		 3w1wA-2hi4A:
21.76
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.
3W1W_B_CHDB504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 450
PHE A 451
LEU A 382
ILE A 372
VAL A 227
 HEM  A 900 (-4.0A)
HEM  A 900 (-4.1A)
HEM  A 900 (-4.0A)
None
None
 1.19A 3w1wB-2hi4A:
undetectable		 3w1wB-2hi4A:
21.76
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.
3W67_C_VIVC301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 ILE A 468
LEU A 433
PHE A 469
ILE A 343
VAL A 350
 None
 1.17A 3w67C-2hi4A:
undetectable		 3w67C-2hi4A:
21.16
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJG_B_NCTB501_1
(CYTOCHROME P450 2A13)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 8 PHE A 125
ALA A 317
THR A 321
LEU A 382
 None
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.68A 4ejgB-2hi4A:
42.9		 4ejgB-2hi4A:
33.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 6 PHE A 125
ALA A 317
THR A 321
LEU A 382
 None
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.71A 4ejgD-2hi4A:
43.0		 4ejgD-2hi4A:
33.66
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 6 PHE A 125
ALA A 317
THR A 321
LEU A 382
 None
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 1.02A 4ejgD-2hi4A:
43.0		 4ejgD-2hi4A:
33.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FN9_A_STRA301_1
(STEROID RECEPTOR 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 LEU A 330
LEU A 333
GLN A 340
ALA A 509
CYH A 504
 None
 1.11A 4fn9A-2hi4A:
undetectable		 4fn9A-2hi4A:
19.13
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.
4K50_E_ACTE504_0
(RNA POLYMERASE
3D-POL)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 VAL A  99
GLY A 102
LYS A 455
 None
 0.76A 4k50E-2hi4A:
undetectable		 4k50E-2hi4A:
21.40
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.
4KM0_B_CP6B201_1
(DIHYDROFOLATE
REDUCTASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 ALA A 230
ILE A 117
PHE A 256
LEU A 264
THR A 229
 None
 1.09A 4km0B-2hi4A:
undetectable		 4km0B-2hi4A:
16.97
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.
4M11_C_MXMC606_2
(PROSTAGLANDIN G/H
SYNTHASE 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 LEU A 111
ARG A 108
MET A 453
 None
HEM  A 900 (-2.4A)
None
 0.90A 4m11C-2hi4A:
undetectable		 4m11C-2hi4A:
22.19
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NKX_A_STRA601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 125
GLY A 316
ALA A 317
THR A 321
ILE A 386
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.42A 4nkxA-2hi4A:
41.4		 4nkxA-2hi4A:
32.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NKX_B_STRB601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 125
GLY A 316
ALA A 317
THR A 321
ILE A 386
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.43A 4nkxB-2hi4A:
41.4		 4nkxB-2hi4A:
32.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NKX_C_STRC601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 125
GLY A 316
ALA A 317
THR A 321
ILE A 386
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.51A 4nkxC-2hi4A:
41.1		 4nkxC-2hi4A:
32.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4NKX_D_STRD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 125
GLY A 316
ALA A 317
THR A 321
ILE A 386
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
 0.45A 4nkxD-2hi4A:
41.2		 4nkxD-2hi4A:
32.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QZT_A_RTLA201_1
(RETINOL-BINDING
PROTEIN 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 PHE A 384
THR A  83
LEU A  57
 None
 0.78A 4qztA-2hi4A:
undetectable		 4qztA-2hi4A:
14.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4R21_B_STRB601_1
(CYTOCHROME P450
FAMILY 17
POLYPEPTIDE 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 9 GLY A 316
ALA A 317
THR A 321
ILE A 386
VAL A 227
 BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
HEM  A 900 ( 3.1A)
HEM  A 900 (-4.0A)
None
 1.01A 4r21B-2hi4A:
40.9		 4r21B-2hi4A:
33.60
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.
4RYA_A_MTLA501_0
(ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL))		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 GLY A 206
ALA A 202
PHE A 315
ALA A 197
VAL A 220
 None
 1.39A 4ryaA-2hi4A:
undetectable		 4ryaA-2hi4A:
22.01
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.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 5 ILE A 117
PHE A 384
SER A 126
ASP A 237
 None
 1.29A 4rzvB-2hi4A:
undetectable		 4rzvB-2hi4A:
19.84
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.
4V1F_B_BQ1B1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 8 ALA A 464
ILE A 468
ALA A 370
PHE A 371
LEU A 472
 HEM  A 900 (-3.6A)
None
None
None
None
 1.31A 4v1fA-2hi4A:
undetectable
4v1fB-2hi4A:
undetectable		 4v1fA-2hi4A:
11.52
4v1fB-2hi4A:
11.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WG0_G_CHDG103_0
(NUCLEAR RECEPTOR
COACTIVATOR 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 11 LEU A 172
GLU A 178
LEU A 176
LEU A 479
LEU A 475
 None
 0.99A 4wg0E-2hi4A:
undetectable
4wg0F-2hi4A:
undetectable
4wg0G-2hi4A:
undetectable		 4wg0E-2hi4A:
3.51
4wg0F-2hi4A:
3.51
4wg0G-2hi4A:
3.51
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.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 ARG A 431
HIS A 378
ARG A 377
 None
 0.85A 5iaoF-2hi4A:
undetectable		 5iaoF-2hi4A:
19.11
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.
5L1F_A_6ZPA902_1
(GLUTAMATE RECEPTOR 2)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 8 PRO A 383
TYR A 495
PHE A 381
SER A 379
 None
None
HEM  A 900 (-4.5A)
None
 0.98A 5l1fA-2hi4A:
undetectable
5l1fB-2hi4A:
undetectable		 5l1fA-2hi4A:
21.21
5l1fB-2hi4A:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TRQ_B_ACTB307_0
(WELO5)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 GLU A 168
HIS A 164
VAL A 199
 None
 0.68A 5trqB-2hi4A:
undetectable		 5trqB-2hi4A:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_C_CHDC308_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 5 LEU A 472
PHE A 471
LEU A 330
PHE A 481
 None
 1.15A 5xdxC-2hi4A:
undetectable
5xdxJ-2hi4A:
undetectable		 5xdxC-2hi4A:
19.60
5xdxJ-2hi4A:
8.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_A_AQ4A602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		6 / 12 PHE A 226
ASN A 257
ASP A 313
GLY A 316
ASP A 320
ILE A 386
 BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.9A)
BHF  A 800 (-3.8A)
BHF  A 800 (-4.0A)
HEM  A 900 (-4.0A)
 0.55A 6dwnA-2hi4A:
55.4		 6dwnA-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_A_AQ4A602_1
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 5 ILE A 117
ALA A 317
LEU A 497
LYS A 500
 None
HEM  A 900 ( 3.5A)
BHF  A 800 (-4.4A)
None
 0.42A 6dwnA-2hi4A:
55.4		 6dwnA-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_B_AQ4B602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		7 / 12 ILE A 117
PHE A 226
ASN A 257
ASP A 313
ASP A 320
ILE A 386
LYS A 500
 None
BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.9A)
BHF  A 800 (-4.0A)
HEM  A 900 (-4.0A)
None
 0.65A 6dwnB-2hi4A:
55.8		 6dwnB-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_B_AQ4B602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		6 / 12 ILE A 117
PHE A 226
ASN A 257
PHE A 260
ASP A 320
LYS A 500
 None
BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.6A)
BHF  A 800 (-4.0A)
None
 0.92A 6dwnB-2hi4A:
55.8		 6dwnB-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_B_AQ4B602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 PHE A 226
LEU A 219
ASP A 313
ILE A 386
LYS A 500
 BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.9A)
HEM  A 900 (-4.0A)
None
 1.44A 6dwnB-2hi4A:
55.8		 6dwnB-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		4 / 7 PHE A 253
GLY A 316
ALA A 317
LEU A 497
 None
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
BHF  A 800 (-4.4A)
 0.35A 6dwnB-2hi4A:
55.8		 6dwnB-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_C_AQ4C602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		7 / 12 ILE A 117
PHE A 226
ASN A 257
ASP A 313
GLY A 316
ILE A 386
LEU A 497
 None
BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.9A)
BHF  A 800 (-3.8A)
HEM  A 900 (-4.0A)
BHF  A 800 (-4.4A)
 0.64A 6dwnC-2hi4A:
55.3		 6dwnC-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_C_AQ4C602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 ILE A 117
PHE A 226
ASN A 257
PHE A 260
LEU A 497
 None
BHF  A 800 (-3.6A)
None
BHF  A 800 (-3.6A)
BHF  A 800 (-4.4A)
 0.89A 6dwnC-2hi4A:
55.3		 6dwnC-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_D_AQ4D602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		8 / 12 ILE A 117
PHE A 226
ASP A 313
GLY A 316
ALA A 317
ASP A 320
ILE A 386
LEU A 497
 None
BHF  A 800 (-3.6A)
BHF  A 800 (-3.9A)
BHF  A 800 (-3.8A)
HEM  A 900 ( 3.5A)
BHF  A 800 (-4.0A)
HEM  A 900 (-4.0A)
BHF  A 800 (-4.4A)
 0.48A 6dwnD-2hi4A:
55.0		 6dwnD-2hi4A:
81.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6DWN_D_AQ4D602_0
(CYTOCHROME P450 1A1)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		5 / 12 ILE A 117
PHE A 226
PHE A 260
ASP A 320
LEU A 497
 None
BHF  A 800 (-3.6A)
BHF  A 800 (-3.6A)
BHF  A 800 (-4.0A)
BHF  A 800 (-4.4A)
 1.01A 6dwnD-2hi4A:
55.0		 6dwnD-2hi4A:
81.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNG_B_QPSB601_3
(-)		 2hi4 CYTOCHROME P450 1A2
(Homo
sapiens) 		3 / 3 ASP A 103
ASP A 128
ASN A 309
 None
 0.65A 6gngB-2hi4A:
undetectable		 6gngB-2hi4A:
21.61