SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5e78'

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.
1FM4_A_DXCA1001_0
(MAJOR POLLEN
ALLERGEN BET V 1-L)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 PHE A 393
PRO A 392
PRO A 358
ILE A 433
ALA A 321
 HEM  A 501 (-4.5A)
None
None
None
None
 1.41A 1fm4A-5e78A:
undetectable		 1fm4A-5e78A:
15.68
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.
1KNY_B_KANB559_1
(KANAMYCIN
NUCLEOTIDYLTRANSFERA
SE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 8 GLU A 344
LYS A   3
SER A  54
ASP A 363
 None
 1.18A 1knyA-5e78A:
1.1
1knyB-5e78A:
undetectable		 1knyA-5e78A:
20.18
1knyB-5e78A:
20.18
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.
1S9P_D_DESD600_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 LEU A 418
ALA A 294
GLU A 293
LEU A 311
LEU A 273
 None
 0.98A 1s9pD-5e78A:
2.7		 1s9pD-5e78A:
20.87
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.
1WRL_A_TFPA202_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 9 MET A 417
LEU A 418
GLU A 409
MET A 145
ALA A 290
 None
 1.43A 1wrlA-5e78A:
undetectable
1wrlB-5e78A:
undetectable		 1wrlA-5e78A:
12.00
1wrlB-5e78A:
12.00
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.
1YC2_D_NCAD510_0
(NAD-DEPENDENT
DEACETYLASE 2)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 ALA A  99
ASN A 253
ILE A 254
ASP A 250
 None
 1.16A 1yc2D-5e78A:
undetectable		 1yc2D-5e78A:
20.26
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.
2WM3_A_NFLA1301_1
(NMRA-LIKE FAMILY
DOMAIN CONTAINING
PROTEIN 1)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 6 LEU A 439
THR A 327
PHE A 275
ASP A 432
 None
HEM  A 501 (-4.6A)
None
None
 1.11A 2wm3A-5e78A:
undetectable		 2wm3A-5e78A:
21.48
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)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 ALA A 264
THR A 268
CYH A 400
 HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 (-2.2A)
 0.46A 3e4eA-5e78A:
34.0		 3e4eA-5e78A:
26.98
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)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 ALA A 264
THR A 268
CYH A 400
 HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 (-2.2A)
 0.41A 3e4eB-5e78A:
34.0		 3e4eB-5e78A:
26.98
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)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 7 LYS A 289
TYR A 313
GLU A 320
PRO A 376
 None
 1.30A 3hs4A-5e78A:
undetectable		 3hs4A-5e78A:
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.
3MDR_A_GJZA506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 6 ILE A 263
ALA A 264
THR A 268
THR A 438
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
None
 0.71A 3mdrA-5e78A:
43.3		 3mdrA-5e78A:
25.83
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.
3MDR_A_GJZA506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 6 LEU A  75
ILE A 263
ALA A 264
THR A 268
 None
None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
 0.80A 3mdrA-5e78A:
43.3		 3mdrA-5e78A:
25.83
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.
3MDR_B_GJZB506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 6 ILE A 263
ALA A 264
THR A 268
ALA A 328
THR A 438
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.79A 3mdrB-5e78A:
43.5		 3mdrB-5e78A:
25.83
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.
3MDT_A_VORA506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 9 ILE A 263
ALA A 264
THR A 268
ALA A 328
THR A 438
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.79A 3mdtA-5e78A:
43.0		 3mdtA-5e78A:
25.83
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.
3MDT_A_VORA506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 9 LEU A  75
ILE A 263
THR A 268
ALA A 328
THR A 438
 None
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 1.14A 3mdtA-5e78A:
43.0		 3mdtA-5e78A:
25.83
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.
3MDT_B_VORB506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 LEU A  75
ALA A 264
THR A 268
ALA A 328
THR A 438
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 1.02A 3mdtB-5e78A:
43.2		 3mdtB-5e78A:
25.83
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.
3MDV_A_CL6A506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 9 LEU A  75
LEU A 181
ILE A 263
ALA A 264
GLU A 267
THR A 438
 None
None
None
HEM  A 501 (-3.6A)
None
None
 1.32A 3mdvA-5e78A:
43.2		 3mdvA-5e78A:
25.83
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.
3MDV_B_CL6B506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		8 / 12 LEU A  75
LEU A 181
ILE A 263
ALA A 264
GLU A 267
THR A 268
ALA A 328
THR A 438
 None
None
None
HEM  A 501 (-3.6A)
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 1.25A 3mdvB-5e78A:
43.2		 3mdvB-5e78A:
25.83
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.
3MDV_B_CL6B506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 12 THR A 260
ALA A 264
GLU A 267
THR A 268
ALA A 328
THR A 438
 None
HEM  A 501 (-3.6A)
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.97A 3mdvB-5e78A:
43.2		 3mdvB-5e78A:
25.83
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.
3OU7_B_SAMB300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 TYR A 166
ASP A 151
ASP A 144
 None
 0.86A 3ou7B-5e78A:
undetectable		 3ou7B-5e78A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q95_A_ESLA700_1
(ESTROGEN RECEPTOR)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 MET A 177
ALA A  82
ILE A 153
GLY A 265
HIS A 266
 None
None
None
HEM  A 501 (-3.2A)
None
 0.97A 3q95A-5e78A:
undetectable		 3q95A-5e78A:
20.43
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.
3Q95_B_ESLB700_1
(ESTROGEN RECEPTOR)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 MET A 177
ALA A  82
ILE A 153
GLY A 265
HIS A 266
 None
None
None
HEM  A 501 (-3.2A)
None
 0.96A 3q95B-5e78A:
undetectable		 3q95B-5e78A:
20.43
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DTZ_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 6 ALA A 264
ALA A 328
PRO A 329
THR A 438
 HEM  A 501 (-3.6A)
HEM  A 501 ( 3.8A)
None
None
 0.53A 4dtzA-5e78A:
63.7		 4dtzA-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DTZ_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT 8C8)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 6 ALA A 264
ALA A 328
PRO A 329
THR A 438
 HEM  A 501 (-3.6A)
HEM  A 501 ( 3.8A)
None
None
 0.52A 4dtzB-5e78A:
63.6		 4dtzB-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DU2_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 7 ALA A 264
ALA A 328
PRO A 329
THR A 438
 HEM  A 501 (-3.6A)
HEM  A 501 ( 3.8A)
None
None
 0.51A 4du2A-5e78A:
63.3		 4du2A-5e78A:
97.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4DU2_B_LDPB501_1
(CYTOCHROME P450 BM3
VARIANT B7)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 7 ALA A 264
ALA A 328
PRO A 329
THR A 438
 HEM  A 501 (-3.6A)
HEM  A 501 ( 3.8A)
None
None
 0.46A 4du2B-5e78A:
63.6		 4du2B-5e78A:
97.58
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.
4EAH_F_ACTF402_0
(ACTIN, ALPHA
SKELETAL MUSCLE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 PHE A 374
ASP A 370
ARG A 378
 None
 0.80A 4eahF-5e78A:
undetectable		 4eahF-5e78A:
22.77
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.
4EAH_G_ACTG401_0
(ACTIN, ALPHA
SKELETAL MUSCLE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 PHE A 374
ASP A 370
ARG A 378
 None
 0.79A 4eahG-5e78A:
undetectable		 4eahG-5e78A:
22.77
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.
4ENH_A_FVXA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 12 LEU A 181
ILE A 263
ALA A 264
THR A 268
ALA A 328
THR A 438
 None
None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.89A 4enhA-5e78A:
43.1		 4enhA-5e78A:
25.83
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.
4G0C_A_AZMA302_1
(CARBONIC ANHYDRASE 2)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 HIS A 266
PHE A  81
LEU A 437
THR A 438
THR A 436
 None
 1.14A 4g0cA-5e78A:
undetectable		 4g0cA-5e78A:
21.44
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.
4J14_A_X2NA602_1
(CHOLESTEROL
24-HYDROXYLASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 10 LEU A  75
ILE A 263
ALA A 264
THR A 268
ALA A 328
THR A 438
 None
None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.91A 4j14A-5e78A:
42.4		 4j14A-5e78A:
25.83
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.
4OK1_A_198A1001_2
(ANDROGEN RECEPTOR)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 8 LEU A 133
MET A 145
LEU A 126
ILE A 453
 None
 1.02A 4ok1A-5e78A:
undetectable		 4ok1A-5e78A:
17.25
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.
4X1K_D_LOCD502_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 LEU A 277
LEU A 287
ALA A 294
VAL A 314
ALA A 290
 None
 1.12A 4x1kD-5e78A:
undetectable		 4x1kD-5e78A:
21.62
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.
4X1Y_B_LOCB502_1
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 LEU A 298
LEU A 412
THR A 152
ALA A 123
VAL A 127
 None
 1.11A 4x1yB-5e78A:
undetectable		 4x1yB-5e78A:
21.62
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.
4X1Y_D_LOCD502_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 LEU A 298
LEU A 412
THR A 152
ALA A 123
VAL A 127
 None
 1.06A 4x1yD-5e78A:
undetectable		 4x1yD-5e78A:
21.62
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.
4X20_D_LOCD502_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 LEU A 298
LEU A 412
THR A 152
ALA A 123
VAL A 127
 None
 1.04A 4x20D-5e78A:
undetectable		 4x20D-5e78A:
21.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ZF8_A_MYTA502_1
(BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 6 LEU A 181
ILE A 263
ALA A 264
THR A 268
ALA A 328
 None
None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
 0.73A 4zf8A-5e78A:
57.9		 4zf8A-5e78A:
98.46
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.
5EWJ_B_QELB503_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 THR A 327
LEU A 437
PRO A 326
ALA A 330
PHE A 393
 HEM  A 501 (-4.6A)
None
None
None
HEM  A 501 (-4.5A)
 1.35A 5ewjA-5e78A:
undetectable
5ewjB-5e78A:
undetectable		 5ewjA-5e78A:
22.42
5ewjB-5e78A:
20.73
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.
5G5G_C_ACTC1740_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 4 VAL A 314
GLU A 293
GLY A 415
LEU A 418
 None
 1.32A 5g5gC-5e78A:
undetectable		 5g5gC-5e78A:
22.07
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.
5H5F_A_SAMA301_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
SFM1)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 LEU A 353
PHE A  67
GLY A 394
LEU A  52
ALA A  61
 None
None
HEM  A 501 (-4.0A)
None
None
 1.09A 5h5fA-5e78A:
undetectable		 5h5fA-5e78A:
19.69
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.
5K9D_A_ACTA405_0
(DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 GLN A 397
THR A  91
ASP A  68
 None
 0.70A 5k9dA-5e78A:
undetectable		 5k9dA-5e78A:
22.03
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.
5L5Z_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 THR A 149
THR A 411
SER A 270
GLY A 271
THR A 327
 None
None
None
None
HEM  A 501 (-4.6A)
 1.34A 5l5zV-5e78A:
undetectable
5l5zb-5e78A:
undetectable		 5l5zV-5e78A:
21.13
5l5zb-5e78A:
18.78
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.
5L5Z_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 THR A 149
THR A 411
SER A 270
GLY A 271
THR A 327
 None
None
None
None
HEM  A 501 (-4.6A)
 1.34A 5l5zH-5e78A:
undetectable
5l5zN-5e78A:
undetectable		 5l5zH-5e78A:
21.13
5l5zN-5e78A:
18.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5OG9_A_TESA503_1
(-)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 9 LEU A  20
VAL A  26
LEU A  29
PRO A 329
ALA A 330
 None
 0.40A 5og9A-5e78A:
57.6		 5og9A-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5OG9_A_TESA504_1
(-)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 8 GLU A 267
THR A 268
ALA A 328
LEU A 437
THR A 438
 None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
None
 0.71A 5og9A-5e78A:
57.6		 5og9A-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5OG9_A_TESA504_1
(-)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 8 VAL A  78
THR A 268
ALA A 328
LEU A 437
THR A 438
 None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
None
 0.44A 5og9A-5e78A:
57.6		 5og9A-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5OG9_B_TESB502_1
(-)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 12 LEU A  20
VAL A  26
LEU A  29
LEU A 188
PRO A 329
ALA A 330
 None
 0.96A 5og9B-5e78A:
58.1		 5og9B-5e78A:
98.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5OG9_B_TESB502_1
(-)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 12 LEU A  20
VAL A  26
LEU A  29
PRO A 329
ALA A 330
LEU A 437
 None
 0.40A 5og9B-5e78A:
58.1		 5og9B-5e78A:
98.24
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.
5TE8_B_08JB602_1
(CYTOCHROME P450 3A4)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 8 THR A 152
ILE A 122
ALA A 123
LEU A 148
 None
 0.56A 5te8B-5e78A:
37.8		 5te8B-5e78A:
28.94
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.
5X23_A_LSNA502_2
(CYTOCHROME P450 2C9)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 LEU A 234
VAL A 216
ASP A 217
 None
 0.30A 5x23A-5e78A:
35.1		 5x23A-5e78A:
28.29
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.
5X6Y_C_SAMC901_0
(MRNA CAPPING ENZYME
P5)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 VAL A 317
GLU A 377
ALA A 290
LEU A 280
ASN A 283
 None
 0.85A 5x6yC-5e78A:
undetectable		 5x6yC-5e78A:
21.44
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.
5XIO_A_HFGA801_1
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 THR A 152
GLU A 409
HIS A 408
 None
 0.83A 5xioA-5e78A:
undetectable		 5xioA-5e78A:
23.55
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.
5XIQ_B_HFGB1002_1
(PROLYL-TRNA
SYNTHETASE (PRORS))		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 THR A 152
GLU A 409
HIS A 408
 None
 0.85A 5xiqB-5e78A:
undetectable		 5xiqB-5e78A:
22.66
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.
5XIQ_D_HFGD1002_1
(PROLYL-TRNA
SYNTHETASE (PRORS))		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 THR A 152
GLU A 409
HIS A 408
 None
 0.84A 5xiqD-5e78A:
undetectable		 5xiqD-5e78A:
22.66
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.
6AWT_D_BEZD202_0
(PR 10 PROTEIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		3 / 3 PHE A 421
ASP A 422
LYS A 451
 None
 0.82A 6awtD-5e78A:
undetectable		 6awtD-5e78A:
17.67
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.
6BBS_A_BZ1A302_1
(CARBONIC ANHYDRASE 2)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 12 HIS A 266
PHE A  81
LEU A 437
THR A 438
THR A 436
 None
 1.07A 6bbsA-5e78A:
undetectable		 6bbsA-5e78A:
10.71
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.
6EW0_B_TA1B501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 323
 None
 1.19A 6ew0B-5e78A:
undetectable		 6ew0B-5e78A:
10.86
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.
6EW0_B_TA1B501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 378
 None
 1.20A 6ew0B-5e78A:
undetectable		 6ew0B-5e78A:
10.86
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.
6EW0_D_TA1D501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 323
 None
 1.19A 6ew0D-5e78A:
undetectable		 6ew0D-5e78A:
10.86
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.
6EW0_D_TA1D501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 378
 None
 1.20A 6ew0D-5e78A:
undetectable		 6ew0D-5e78A:
10.86
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.
6EW0_H_TA1H501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 323
 None
 1.18A 6ew0H-5e78A:
undetectable		 6ew0H-5e78A:
10.86
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.
6EW0_H_TA1H501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 378
 None
 1.20A 6ew0H-5e78A:
undetectable		 6ew0H-5e78A:
10.86
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.
6EW0_I_TA1I501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 323
 None
 1.18A 6ew0I-5e78A:
undetectable		 6ew0I-5e78A:
10.86
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.
6EW0_I_TA1I501_2
(TUBULIN BETA CHAIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 5 LEU A 277
THR A 411
PRO A 376
ARG A 378
 None
 1.20A 6ew0I-5e78A:
undetectable		 6ew0I-5e78A:
10.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6H1L_A_FJQA501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 10 ALA A  74
LEU A  75
VAL A  78
THR A 268
ALA A 328
 None
None
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
 0.49A 6h1lA-5e78A:
57.1		 6h1lA-5e78A:
99.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		6 / 11 ALA A  74
LEU A  75
VAL A  78
THR A  88
THR A 268
ALA A 328
 None
None
None
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
 0.40A 6h1lB-5e78A:
55.5		 6h1lB-5e78A:
99.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 ILE A 263
ALA A 264
THR A 268
ALA A 328
LEU A 437
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.80A 6h1lB-5e78A:
55.5		 6h1lB-5e78A:
99.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 THR A  88
ALA A 264
THR A 268
ALA A 328
LEU A 437
 None
HEM  A 501 (-3.6A)
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 0.81A 6h1lB-5e78A:
55.5		 6h1lB-5e78A:
99.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		5 / 11 VAL A  78
THR A  88
THR A 268
ALA A 328
LEU A 437
 None
None
HEM  A 501 (-3.4A)
HEM  A 501 ( 3.8A)
None
 1.11A 6h1lB-5e78A:
55.5		 6h1lB-5e78A:
99.12
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.
6MDQ_A_TESA604_0
(SERUM ALBUMIN)		 5e78 BIFUNCTIONAL
P-450/NADPH-P450
REDUCTASE
(Bacillus
megaterium) 		4 / 8 ALA A 276
GLY A 271
LEU A 272
ALA A 410
 None
None
HEM  A 501 ( 4.2A)
None
 0.77A 6mdqA-5e78A:
undetectable		 6mdqA-5e78A:
11.38