SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1o94'

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.
1L2I_B_CCSB417_0
(ESTROGEN RECEPTOR)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		4 / 6 PRO C  66
GLN C   9
LYS C   8
VAL C   7
 None
 1.43A 1l2iB-1o94C:
0.0		 1l2iB-1o94C:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MT1_K_AG2K7002_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 ILE A 607
LEU A 534
LEU A 589
GLY A 590
 None
 0.88A 1mt1H-1o94A:
undetectable
1mt1K-1o94A:
undetectable		 1mt1H-1o94A:
9.45
1mt1K-1o94A:
6.37
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.
1N2X_A_SAMA401_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		6 / 12 THR A 257
GLY A 259
GLU A 266
VAL A 225
ASP A 226
VAL A 228
 None
 1.35A 1n2xA-1o94A:
5.5		 1n2xA-1o94A:
18.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N2X_A_SAMA401_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		6 / 12 THR A 257
GLY A 259
GLY A 265
VAL A 225
ASP A 226
VAL A 228
 None
 1.44A 1n2xA-1o94A:
5.5		 1n2xA-1o94A:
18.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q23_B_FUAB703_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		3 / 3 VAL C 145
ALA C 144
HIS C 142
 None
 0.74A 1q23C-1o94C:
undetectable		 1q23C-1o94C:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q23_K_FUAK712_2
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		3 / 3 VAL C 145
ALA C 144
HIS C 142
 None
 0.63A 1q23L-1o94C:
undetectable		 1q23L-1o94C:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S14_A_NOVA1300_1
(TOPOISOMERASE IV
SUBUNIT B)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLU A 372
MET A 362
PRO A 361
ILE A  31
ARG A 354
 None
FMN  A1730 ( 4.3A)
None
None
None
 1.50A 1s14A-1o94A:
undetectable		 1s14A-1o94A:
14.54
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.
1S14_B_NOVB2300_1
(TOPOISOMERASE IV
SUBUNIT B)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLU A 372
MET A 362
PRO A 361
ILE A  31
ARG A 354
 None
FMN  A1730 ( 4.3A)
None
None
None
 1.41A 1s14B-1o94A:
undetectable		 1s14B-1o94A:
14.54
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.
1SDT_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 10 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.98A 1sdtA-1o94A:
undetectable		 1sdtA-1o94A:
10.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T3R_A_017A1200_2
(PROTEASE RETROPEPSIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.96A 1t3rB-1o94A:
undetectable		 1t3rB-1o94A:
10.00
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.
2AOJ_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 7 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.95A 2aojB-1o94A:
undetectable		 2aojB-1o94A:
10.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVO_B_MK1B902_1
(POL POLYPROTEIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 9 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 1.02A 2avoA-1o94A:
undetectable		 2avoA-1o94A:
10.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BR4_E_SAME301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		3 / 3 SER C 123
ASP C  40
CYH C  76
 None
 0.99A 2br4E-1o94C:
undetectable		 2br4E-1o94C:
21.07
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.
2F16_H_BO2H1400_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 SER A 158
ALA A 154
ALA A 100
GLY A 101
CYH A  61
 None
 1.01A 2f16H-1o94A:
undetectable
2f16I-1o94A:
undetectable		 2f16H-1o94A:
16.72
2f16I-1o94A:
15.78
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.
2F16_V_BO2V1401_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 SER A 158
ALA A 154
ALA A 100
GLY A 101
CYH A  61
 None
 1.01A 2f16V-1o94A:
undetectable
2f16W-1o94A:
undetectable		 2f16V-1o94A:
16.72
2f16W-1o94A:
15.78
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.
2FK8_A_SAMA302_0
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		7 / 12 THR A  70
ILE A  31
GLY A  32
GLY A 359
GLY A 371
GLU A 373
ALA A  33
 None
 1.41A 2fk8A-1o94A:
undetectable		 2fk8A-1o94A:
16.87
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.
2FL5_B_RBFB202_1
(IMMUNOGLOBULIN IGG1
LAMBDA LIGHT CHAIN
IMMUNOGLOBULIN IGG1
HEAVY CHAIN)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		5 / 11 GLY D 101
TYR D 102
PRO D  72
ARG D  15
GLU D   8
 None
 1.33A 2fl5A-1o94D:
0.0
2fl5B-1o94D:
undetectable
2fl5F-1o94D:
undetectable		 2fl5A-1o94D:
22.60
2fl5B-1o94D:
23.05
2fl5F-1o94D:
23.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2GLU_A_SAMA301_0
(YCGJ)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLY A 401
GLY A 688
HIS A 689
THR A 487
ARG A 406
 None
None
None
ADP  A1731 (-4.2A)
None
 1.00A 2gluA-1o94A:
4.7		 2gluA-1o94A:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IGT_C_SAMC1003_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		5 / 12 HIS D  86
PHE D  75
ALA D 176
ALA D  81
GLY D  65
 None
 1.31A 2igtC-1o94D:
2.3		 2igtC-1o94D:
23.48
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.
2JAP_A_J01A1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 417
ILE A 672
ALA A 486
ALA A 397
LEU A 393
 None
 1.20A 2japA-1o94A:
3.0		 2japA-1o94A:
17.21
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.
2JAP_B_J01B1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 417
ILE A 672
ALA A 486
ALA A 397
LEU A 393
 None
 1.19A 2japB-1o94A:
2.2		 2japB-1o94A:
17.21
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.
2JAP_C_J01C1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 417
ILE A 672
ALA A 486
ALA A 397
LEU A 393
 None
 1.20A 2japC-1o94A:
3.3		 2japC-1o94A:
17.21
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.
2JAP_D_J01D1249_1
(CLAVALDEHYDE
DEHYDROGENASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 417
ILE A 672
ALA A 486
ALA A 397
LEU A 393
 None
 1.20A 2japD-1o94A:
3.2		 2japD-1o94A:
17.21
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.
2O5Y_H_STRH249_1
(CHIMERIC ANTIBODY
FAB 1E9-DB3)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 ASN A 458
GLY A 412
THR A 386
MET A 409
 None
 1.25A 2o5yH-1o94A:
undetectable
2o5yL-1o94A:
undetectable		 2o5yH-1o94A:
15.38
2o5yL-1o94A:
13.61
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.
2OXT_B_SAMB300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLY A 488
GLY A 688
GLY A 401
GLY A 398
LEU A 408
 ADP  A1731 (-3.1A)
None
None
ADP  A1731 (-3.4A)
None
 0.84A 2oxtB-1o94A:
4.2		 2oxtB-1o94A:
18.52
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.
2QEU_A_ACTA141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus;
Methylophilus
methylotrophus) 		3 / 3 VAL D  97
ASP D  98
GLU C 165
 None
 0.65A 2qeuA-1o94D:
undetectable		 2qeuA-1o94D:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_C_ACTC141_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus;
Methylophilus
methylotrophus) 		3 / 3 VAL D  97
ASP D  98
GLU C 165
 None
 0.66A 2qeuC-1o94D:
undetectable		 2qeuC-1o94D:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQC_E_AG2E671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 ILE A 607
LEU A 534
LEU A 589
GLY A 590
 None
 0.83A 2qqcD-1o94A:
undetectable
2qqcE-1o94A:
0.0		 2qqcD-1o94A:
9.59
2qqcE-1o94A:
6.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QQC_K_AG2K671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 ILE A 607
LEU A 534
LEU A 589
GLY A 590
 None
 0.85A 2qqcH-1o94A:
undetectable
2qqcK-1o94A:
undetectable		 2qqcH-1o94A:
9.59
2qqcK-1o94A:
6.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ADX_B_IMNB3_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 393
GLY A 426
ALA A 405
ILE A 451
LEU A 463
 None
ADP  A1731 (-3.3A)
None
None
None
 0.97A 3adxB-1o94A:
undetectable		 3adxB-1o94A:
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.
3B9M_A_SALA1200_1
(SERUM ALBUMIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 ILE A 681
HIS A 427
ARG A 444
GLY A 398
 None
ADP  A1731 (-3.8A)
None
ADP  A1731 (-3.4A)
 1.18A 3b9mA-1o94A:
0.0		 3b9mA-1o94A:
21.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CSJ_B_CBLB211_0
(GLUTATHIONE
S-TRANSFERASE P)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 9 PRO A 281
GLY A 296
ILE A 318
TYR A 300
GLY A 277
 None
 1.31A 3csjB-1o94A:
undetectable		 3csjB-1o94A:
15.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D1Y_A_ROCA201_2
(HIV-1 PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 9 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.94A 3d1yB-1o94A:
undetectable		 3d1yB-1o94A:
10.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MG0_V_BO2V1401_1
(PROTEASOME COMPONENT
PUP1
PROTEASOME COMPONENT
PUP3)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 SER A 158
ALA A 154
ALA A 100
GLY A 101
CYH A  61
 None
 1.00A 3mg0V-1o94A:
undetectable
3mg0W-1o94A:
undetectable		 3mg0V-1o94A:
16.72
3mg0W-1o94A:
15.78
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.
3N3I_A_ROCA201_2
(PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 ILE A 695
ASP A 674
GLY A 688
VAL A 395
 None
ADP  A1731 (-3.2A)
None
ADP  A1731 (-4.7A)
 0.99A 3n3iA-1o94A:
undetectable		 3n3iA-1o94A:
15.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NRR_A_D16A520_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		5 / 12 PHE D  48
LEU D  14
ARG D  15
PRO D 162
LEU D  52
 None
 1.15A 3nrrA-1o94D:
2.8		 3nrrA-1o94D:
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.
3OGP_A_017A200_2
(FIV PROTEASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		5 / 10 LEU D 153
ALA D  24
ILE D  22
VAL D   5
LEU D  92
 None
 1.14A 3ogpB-1o94D:
undetectable		 3ogpB-1o94D:
16.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGQ_A_AB1A200_1
(FIV PROTEASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		5 / 10 ALA C   6
VAL C 116
GLY C 101
ILE C 103
LEU C   4
 AMP  C1236 (-3.6A)
None
None
None
None
 1.00A 3ogqA-1o94C:
undetectable		 3ogqA-1o94C:
17.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OY4_B_017B200_1
(HIV-1 PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.96A 3oy4A-1o94A:
undetectable		 3oy4A-1o94A:
9.86
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.
3RQW_C_ACHC323_0
(ELIC PENTAMERIC
LIGAND GATED ION
CHANNEL FROM ERWINIA
CHRYSANTHEMI)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 TYR A 183
ASN A 181
GLU A 129
TYR A 229
 None
 1.06A 3rqwC-1o94A:
undetectable
3rqwD-1o94A:
undetectable		 3rqwC-1o94A:
18.60
3rqwD-1o94A:
18.60
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.
3S8P_B_SAMB500_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 HIS A 592
SER A 595
ASN A 627
 None
 0.75A 3s8pB-1o94A:
0.0		 3s8pB-1o94A:
18.00
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.
3T3C_A_017A201_2
(HIV-1 PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 10 ASP A 390
VAL A 392
ILE A 695
ALA A 405
VAL A 415
 None
 0.99A 3t3cB-1o94A:
undetectable		 3t3cB-1o94A:
9.72
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.
3V8V_A_SAMA801_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE L)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLY A 214
SER A 215
ASP A 252
VAL A 102
LEU A 104
 None
 1.19A 3v8vA-1o94A:
4.8		 3v8vA-1o94A:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3VYW_C_SAMC401_1
(MNMC2)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 GLY A 401
ASP A 445
ASP A 419
ASN A 429
 None
None
ADP  A1731 (-2.7A)
None
 0.98A 3vywC-1o94A:
undetectable		 3vywC-1o94A:
17.19
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.
4B17_A_SAMA1358_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE M)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 GLY A 359
GLY A 358
ASP A  36
ASP A  82
ASP A  69
 None
 1.10A 4b17A-1o94A:
2.8		 4b17A-1o94A:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DQH_B_017B101_1
(WILD-TYPE HIV-1
PROTEASE DIMER)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 11 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.99A 4dqhA-1o94A:
undetectable		 4dqhA-1o94A:
9.72
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.
4FGZ_A_CQAA301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 GLY A 224
TYR A  25
LEU A 295
VAL A 297
 None
None
None
FMN  A1730 (-3.7A)
 0.89A 4fgzA-1o94A:
undetectable		 4fgzA-1o94A:
17.01
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.
4GBO_B_CUB301_0
(E7)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 HIS A 110
ALA A 111
GLN A 178
TYR A 126
 None
 1.25A 4gboB-1o94A:
undetectable		 4gboB-1o94A:
14.58
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.
4I00_A_ZMRA509_1
(NEURAMINIDASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 ARG A 354
ASP A 683
ALA A 703
GLU A 372
ARG A 375
 None
 1.09A 4i00A-1o94A:
undetectable		 4i00A-1o94A:
18.35
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.
4IB4_A_ERMA2001_1
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 VAL A 228
TRP A 202
PHE A 223
PHE A 243
LEU A 285
 None
 1.26A 4ib4A-1o94A:
undetectable		 4ib4A-1o94A:
20.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LL3_A_017A201_1
(PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 8 ALA A 405
VAL A 392
GLY A 688
VAL A 395
ILE A 394
 None
None
None
ADP  A1731 (-4.7A)
None
 1.42A 4ll3A-1o94A:
undetectable		 4ll3A-1o94A:
9.72
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.
4MK4_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 VAL A 691
ARG A 690
VAL A 395
GLY A 396
 None
None
ADP  A1731 (-4.7A)
ADP  A1731 (-3.4A)
 0.89A 4mk4A-1o94A:
3.0		 4mk4A-1o94A:
19.08
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.
4NKV_C_AERC601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		4 / 6 ASP C 212
GLU C 106
VAL C 220
ALA C  92
 None
 1.17A 4nkvC-1o94C:
0.0		 4nkvC-1o94C:
18.56
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.
4NSB_A_AINA402_1
(CHITINASE-3-LIKE
PROTEIN 1)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 THR A 221
TRP A 254
TRP A 202
LEU A 206
 None
 1.48A 4nsbA-1o94A:
6.4		 4nsbA-1o94A:
20.08
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.
4OLT_A_GCSA304_1
(CHITOSANASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		4 / 4 TYR D 112
ILE D  83
THR D 150
TYR D 102
 None
 1.37A 4oltA-1o94D:
0.0		 4oltA-1o94D:
21.26
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.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 177
GLU A 103
THR A 257
ARG A 222
GLY A 298
 None
FMN  A1730 (-2.7A)
None
FMN  A1730 (-2.8A)
FMN  A1730 ( 4.2A)
 1.23A 4q15B-1o94A:
4.1		 4q15B-1o94A:
21.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Q1X_A_017A101_2
(ASPARTYL PROTEASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 0.90A 4q1xB-1o94A:
undetectable		 4q1xB-1o94A:
10.00
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.
4UCK_A_SAMA2409_1
(RNA-DIRECTED RNA
POLYMERASE L)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		3 / 3 SER C 123
ASP C  70
ASP C  39
 None
None
AMP  C1236 (-2.6A)
 0.74A 4uckA-1o94C:
undetectable		 4uckA-1o94C:
21.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UYM_B_VORB590_1
(14-ALPHA STEROL
DEMETHYLASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 TYR A 539
ALA A 682
ILE A 346
LEU A 428
 None
None
SF4  A1732 (-4.5A)
None
 0.81A 4uymB-1o94A:
0.0		 4uymB-1o94A:
21.73
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.
5ALB_L_TIQL1210_2
(MEDI2452 LIGHT CHAIN)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
(Methylophilus
methylotrophus) 		4 / 8 SER C 133
TYR C 137
GLY C 101
ALA C 222
 None
 0.89A 5albL-1o94C:
undetectable		 5albL-1o94C:
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.
5CDN_G_EVPG2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 GLU A 131
GLY A 224
ARG A 222
GLY A 170
 None
None
FMN  A1730 (-2.8A)
None
 0.73A 5cdnA-1o94A:
undetectable
5cdnB-1o94A:
undetectable		 5cdnA-1o94A:
22.83
5cdnB-1o94A:
13.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDN_O_EVPO2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 GLU A 131
GLY A 224
ARG A 222
GLY A 170
 None
None
FMN  A1730 (-2.8A)
None
 0.76A 5cdnC-1o94A:
0.0
5cdnD-1o94A:
undetectable		 5cdnC-1o94A:
22.83
5cdnD-1o94A:
13.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CDN_P_EVPP2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 GLU A 131
GLY A 224
ARG A 222
GLY A 170
 None
None
FMN  A1730 (-2.8A)
None
 0.73A 5cdnT-1o94A:
0.0
5cdnU-1o94A:
undetectable		 5cdnT-1o94A:
22.83
5cdnU-1o94A:
13.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CPR_B_SAMB402_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 HIS A 592
SER A 595
ASN A 627
 None
 0.77A 5cprB-1o94A:
0.0		 5cprB-1o94A:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 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)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 ARG A 343
HIS A 689
ARG A 406
 None
 1.03A 5iaoC-1o94A:
undetectable		 5iaoC-1o94A:
13.67
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.
5IAO_C_URFC301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 ARG A 447
HIS A 689
ARG A 406
 None
 0.90A 5iaoC-1o94A:
undetectable		 5iaoC-1o94A:
13.67
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.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 ARG A 343
HIS A 689
ARG A 406
 None
 1.03A 5iaoF-1o94A:
undetectable		 5iaoF-1o94A:
13.67
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.
5IAO_F_URFF301_1
(BIFUNCTIONAL PROTEIN
PYRR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 ARG A 447
HIS A 689
ARG A 406
 None
 0.89A 5iaoF-1o94A:
undetectable		 5iaoF-1o94A:
13.67
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.
5KR2_C_ROCC101_2
(PROTEASE PR5-SQV)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 9 LEU A 650
GLY A 668
ILE A 666
VAL A 395
ILE A 485
 ADP  A1731 ( 4.6A)
None
None
ADP  A1731 (-4.7A)
None
 1.04A 5kr2D-1o94A:
undetectable		 5kr2D-1o94A:
10.14
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.
5MSD_A_BEZA1202_0
(CARBOXYLIC ACID
REDUCTASE)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus;
Methylophilus
methylotrophus) 		4 / 5 HIS C 142
ILE C 132
PHE D  70
ALA D 103
 None
 1.18A 5msdA-1o94C:
2.4		 5msdA-1o94C:
13.58
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.
5N0R_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 4 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.29A 5n0rA-1o94A:
0.7		 5n0rA-1o94A:
19.86
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.
5N0S_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 4 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.27A 5n0sA-1o94A:
0.7		 5n0sA-1o94A:
19.86
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.
5N0T_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.27A 5n0tA-1o94A:
0.6		 5n0tA-1o94A:
19.86
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.
5N0W_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 4 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.27A 5n0wA-1o94A:
0.8		 5n0wA-1o94A:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0W_B_SAMB501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.28A 5n0wB-1o94A:
0.6		 5n0wB-1o94A:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0X_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 4 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.26A 5n0xA-1o94A:
0.0		 5n0xA-1o94A:
19.86
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.
5N4I_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 SER A 158
ALA A 161
GLN A  41
THR A  90
 None
 1.28A 5n4iA-1o94A:
0.7		 5n4iA-1o94A:
19.86
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.
5UC3_A_486A801_2
(GLUCOCORTICOID
RECEPTOR)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 5 LEU C 194
MET A 470
GLN A 462
TYR C 191
 None
 0.68A 5uc3A-1o94C:
undetectable		 5uc3A-1o94C:
14.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V0V_A_8QSA615_1
(SERUM ALBUMIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 TYR A  25
ARG A 222
LEU A  56
ILE A 165
 None
FMN  A1730 (-2.8A)
None
None
 0.86A 5v0vA-1o94A:
undetectable		 5v0vA-1o94A:
21.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VLM_A_CVIA301_1
(REGULATORY PROTEIN
TETR)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
ALPHA-SUBUNIT
(Methylophilus
methylotrophus) 		4 / 8 GLY D 101
ARG D 182
GLN D 180
ASP D  73
 None
 1.05A 5vlmA-1o94D:
undetectable		 5vlmA-1o94D:
19.56
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.
5XIO_A_HFGA801_1
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 THR A 516
GLU A 518
HIS A 645
 None
 0.88A 5xioA-1o94A:
3.7		 5xioA-1o94A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XIQ_B_HFGB1002_1
(PROLYL-TRNA
SYNTHETASE (PRORS))		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 THR A 516
GLU A 518
HIS A 645
 None
 0.88A 5xiqB-1o94A:
undetectable		 5xiqB-1o94A:
22.21
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.
5Y9Y_A_ACTA412_0
(UNCHARACTERIZED
PROTEIN KDOO)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		3 / 3 ARG A 343
PHE A 383
ARG A 406
 None
 1.07A 5y9yA-1o94A:
0.0		 5y9yA-1o94A:
17.87
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.
5YCP_A_BRLA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		5 / 12 CYH A 348
SER A 271
ILE A 352
LEU A 428
LEU A 437
 SF4  A1732 (-2.3A)
None
FMN  A1730 (-4.3A)
None
None
 1.45A 5ycpA-1o94A:
0.0		 5ycpA-1o94A:
9.48
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.
6CDU_A_EY4A502_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 ALA A 155
TYR A 151
VAL A 166
PRO A  28
 None
None
None
FMN  A1730 (-4.8A)
 0.92A 6cduA-1o94A:
0.0
6cduE-1o94A:
0.0		 6cduA-1o94A:
17.78
6cduE-1o94A:
17.78
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.
6CDU_E_EY4E500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 8 VAL A 166
PRO A  28
ALA A 155
TYR A 151
 None
FMN  A1730 (-4.8A)
None
None
 0.91A 6cduD-1o94A:
undetectable
6cduE-1o94A:
undetectable		 6cduD-1o94A:
17.78
6cduE-1o94A:
17.78
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.
6CDU_H_EY4H500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 7 VAL A 166
PRO A  28
ALA A 155
TYR A 151
 None
FMN  A1730 (-4.8A)
None
None
 0.92A 6cduH-1o94A:
undetectable
6cduI-1o94A:
0.0		 6cduH-1o94A:
17.78
6cduI-1o94A:
17.78
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.
6CJK_C_ACTC301_0
(IMMUNOGLOBULIN FAB
LIGHT CHAIN)		 1o94 TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 4 VAL A 228
GLY A 259
ASP A 260
ASP A 267
 None
None
None
FMN  A1730 (-2.6A)
 1.40A 6cjkC-1o94A:
undetectable		 6cjkC-1o94A:
15.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F88_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 1o94 ELECTRON TRANSFER
FLAVOPROTEIN
BETA-SUBUNIT
TRIMETHYLAMINE
DEHYDROGENASE
(Methylophilus
methylotrophus) 		4 / 6 LEU A 393
ALA A 480
SER C 193
ASN A 458
 None
 1.03A 6f88A-1o94A:
undetectable		 6f88A-1o94A:
8.83