SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1tmo'

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.
1E7C_A_HLTA4001_1
(SERUM ALBUMIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 5 LYS A 400
ALA A 402
ASP A 433
GLY A 419
 None
 1.20A 1e7cA-1tmoA:
undetectable		 1e7cA-1tmoA:
21.51
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.
1FM6_D_BRLD503_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 4 ILE A 176
LEU A 237
VAL A 223
ILE A 221
 None
 0.74A 1fm6D-1tmoA:
0.0		 1fm6D-1tmoA:
15.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GMK_C_DVAC6_0
(GRAMICIDIN A)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 ALA A 255
VAL A 250
TRP A 627
 None
 0.99A 1gmkC-1tmoA:
undetectable
1gmkD-1tmoA:
undetectable		 1gmkC-1tmoA:
1.88
1gmkD-1tmoA:
1.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HK5_A_T44A1008_1
(SERUM ALBUMIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 10 ASP A 312
LYS A 315
ALA A 314
GLU A 240
VAL A 305
 None
 1.31A 1hk5A-1tmoA:
0.0		 1hk5A-1tmoA:
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.
1MX8_A_RTLA135_0
(CELLULAR
RETINOL-BINDING
PROTEIN I, HOLO)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 LEU A 265
ALA A 314
LEU A 313
THR A 182
ILE A 350
 None
 1.29A 1mx8A-1tmoA:
undetectable		 1mx8A-1tmoA:
10.35
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.
1OXR_A_AINA141_1
(PHOSPHOLIPASE A2
ISOFORM 3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 4 LEU A 505
GLY A  17
ASP A  37
TYR A 496
 None
 1.13A 1oxrA-1tmoA:
undetectable		 1oxrA-1tmoA:
9.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P91_B_SAMB2401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 LEU A 185
GLY A 357
GLY A 359
ILE A 183
LEU A 194
 None
 1.03A 1p91B-1tmoA:
undetectable		 1p91B-1tmoA:
16.40
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.
1R15_D_NCAD349_0
(ADP-RIBOSYL CYCLASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 GLU A 662
ASN A 470
TRP A 727
 None
 1.29A 1r15D-1tmoA:
undetectable		 1r15D-1tmoA:
16.10
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.
1R15_F_NCAF369_0
(ADP-RIBOSYL CYCLASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 GLU A 662
ASN A 470
TRP A 727
 None
 1.25A 1r15F-1tmoA:
undetectable		 1r15F-1tmoA:
16.10
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.
1SQF_A_SAMA430_1
(SUN PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 PRO A 246
ASP A 249
ASP A 227
 None
2MD  A 800 (-3.1A)
2MD  A 800 (-2.8A)
 0.81A 1sqfA-1tmoA:
undetectable		 1sqfA-1tmoA:
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.
1ZLQ_A_ACTA1507_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 GLN A 323
HIS A 364
ARG A 586
 None
 1.01A 1zlqA-1tmoA:
undetectable		 1zlqA-1tmoA:
21.02
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.
2AOX_A_THAA400_1
(HISTAMINE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 PHE A  16
GLN A 659
TRP A 118
TRP A 198
 None
2MD  A 799 (-3.7A)
2MO  A 801 ( 3.9A)
None
 1.22A 2aoxA-1tmoA:
2.4		 2aoxA-1tmoA:
15.40
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.
2AOX_B_THAB401_1
(HISTAMINE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 7 PHE A  16
GLN A 659
TRP A 118
TRP A 198
 None
2MD  A 799 (-3.7A)
2MO  A 801 ( 3.9A)
None
 1.21A 2aoxB-1tmoA:
2.6		 2aoxB-1tmoA:
15.40
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.
2F16_2_BO221405_1
(PROTEASOME COMPONENT
PRE3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.21A 2f162-1tmoA:
undetectable		 2f162-1tmoA:
12.92
Potential target for repurposing, i.e. matched protein structure has less than 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_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.20A 2f16N-1tmoA:
undetectable		 2f16N-1tmoA:
12.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2G70_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 VAL A  57
ALA A 473
PHE A 477
CYH A 475
VAL A 481
 None
 1.15A 2g70A-1tmoA:
undetectable		 2g70A-1tmoA:
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.
2G70_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 VAL A  57
ALA A 473
PHE A 477
CYH A 475
VAL A 481
 None
 1.15A 2g70B-1tmoA:
undetectable		 2g70B-1tmoA:
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.
2G72_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 VAL A  57
ALA A 473
PHE A 477
CYH A 475
VAL A 481
 None
 1.16A 2g72A-1tmoA:
undetectable		 2g72A-1tmoA:
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.
2IVU_A_ZD6A3015_1
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE RECEPTOR RET
PRECURSOR)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 ALA A 745
GLY A  79
SER A 788
 None
 0.58A 2ivuA-1tmoA:
undetectable		 2ivuA-1tmoA:
17.70
Potential target for repurposing, i.e. matched protein structure has less than 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_B_CHDB502_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 7 ILE A 794
ARG A  82
PRO A 785
GLY A 732
 None
 1.22A 2pnjB-1tmoA:
undetectable		 2pnjB-1tmoA:
17.73
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.
2Q6H_A_CXXA801_1
(TRANSPORTER)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 LEU A 346
GLN A 352
ILE A 256
PHE A 324
LEU A 313
 None
 1.28A 2q6hA-1tmoA:
undetectable		 2q6hA-1tmoA:
22.35
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.
2QBM_A_CAMA517_0
(CYTOCHROME P450-CAM)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 8 PHE A 524
VAL A 465
THR A 466
ASP A 520
ILE A 523
 None
None
None
2MD  A 799 (-3.4A)
None
 1.22A 2qbmA-1tmoA:
undetectable		 2qbmA-1tmoA:
18.77
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.
2QEO_A_LNRA200_1
(D7R4 PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 ILE A 261
VAL A 282
TYR A 266
PHE A 278
GLU A 279
 None
 1.48A 2qeoA-1tmoA:
0.0		 2qeoA-1tmoA:
10.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y6R_D_CTCD1385_0
(TETX2 PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 10 ASP A 653
PHE A  16
HIS A 203
GLY A  17
MET A  50
 None
 1.46A 2y6rD-1tmoA:
0.2		 2y6rD-1tmoA:
19.76
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.
3A25_A_SAMA279_1
(UNCHARACTERIZED
PROTEIN PH0793)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 MET A  43
GLU A 662
ASP A 468
 None
None
2MD  A 799 (-3.1A)
 1.04A 3a25A-1tmoA:
undetectable		 3a25A-1tmoA:
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.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 ARG A 410
ILE A 415
TRP A 411
 None
 1.12A 3e7iB-1tmoA:
undetectable		 3e7iB-1tmoA:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MG0_2_BO221405_1
(PROTEASOME COMPONENT
PRE3
PROTEASOME COMPONENT
PUP1)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.16A 3mg02-1tmoA:
undetectable
3mg0V-1tmoA:
undetectable		 3mg02-1tmoA:
12.92
3mg0V-1tmoA:
14.34
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.
3MG0_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.16A 3mg0N-1tmoA:
undetectable		 3mg0N-1tmoA:
12.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 ARG A 410
ILE A 415
TRP A 411
 None
 1.15A 3nw2B-1tmoA:
undetectable		 3nw2B-1tmoA:
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.
3OXV_C_478C200_1
(HIV-1 PROTEASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 9 GLY A 708
ALA A 709
ASP A 692
VAL A 720
ILE A 690
 None
 0.97A 3oxvC-1tmoA:
undetectable		 3oxvC-1tmoA:
8.56
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.
3V3O_C_T1CC401_1
(TETX2 PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 ASP A 653
PHE A  16
HIS A 203
GLY A  17
MET A  50
 None
 1.32A 3v3oC-1tmoA:
0.0		 3v3oC-1tmoA:
18.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AC9_B_DXCB1473_0
(MJ0495-LIKE PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 ILE A 415
ASP A 413
ILE A 412
PHE A 458
GLN A 115
 None
 1.07A 4ac9B-1tmoA:
undetectable
4ac9C-1tmoA:
undetectable		 4ac9B-1tmoA:
20.73
4ac9C-1tmoA:
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.
4ECK_A_FOLA703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 VAL A 530
LEU A 482
PHE A 524
PHE A 527
LEU A  99
 None
 1.17A 4eckA-1tmoA:
undetectable		 4eckA-1tmoA:
21.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 7 PHE A 527
GLY A 136
ILE A 438
PHE A  95
 None
 0.90A 4ejjA-1tmoA:
undetectable		 4ejjA-1tmoA:
19.50
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.
4IKJ_B_SUZB201_1
(TRANSTHYRETIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 SER A 129
SER A 127
ALA A 381
SER A 126
 None
2MD  A 799 (-3.4A)
None
None
 0.64A 4ikjA-1tmoA:
undetectable
4ikjB-1tmoA:
undetectable		 4ikjA-1tmoA:
11.32
4ikjB-1tmoA:
11.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IKK_A_SUZA201_1
(TRANSTHYRETIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 ALA A 381
SER A 126
SER A 129
SER A 127
 None
None
None
2MD  A 799 (-3.4A)
 0.71A 4ikkA-1tmoA:
undetectable
4ikkB-1tmoA:
undetectable		 4ikkA-1tmoA:
11.32
4ikkB-1tmoA:
11.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4J4V_A_SVRA301_1
(NUCLEOCAPSID PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 11 GLY A 708
ARG A 688
ALA A 685
VAL A 710
ILE A 722
 None
 1.31A 4j4vA-1tmoA:
0.0		 4j4vA-1tmoA:
14.59
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.
4KF9_A_ACTA407_0
(GLUTATHIONE
S-TRANSFERASE
PROTEIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 GLU A 165
ARG A 586
HIS A 587
 None
 0.72A 4kf9A-1tmoA:
undetectable		 4kf9A-1tmoA:
17.69
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.
4M48_A_21BA704_1
(TRANSPORTER)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 PHE A  19
ASP A  37
TYR A 496
GLY A  13
 None
 0.88A 4m48A-1tmoA:
undetectable		 4m48A-1tmoA:
21.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4POO_A_SAMA301_0
(PUTATIVE RNA
METHYLASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 GLY A 703
ASN A 700
SER A 748
LEU A 755
SER A 789
 None
 1.34A 4pooA-1tmoA:
2.1		 4pooA-1tmoA:
14.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QA0_A_SHHA404_2
(HISTONE DEACETYLASE
8)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 PRO A  60
MET A  61
TYR A  59
 None
 1.06A 4qa0B-1tmoA:
2.6		 4qa0B-1tmoA:
18.59
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.
4QA0_B_SHHB404_1
(HISTONE DEACETYLASE
8)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 PRO A  60
MET A  61
TYR A  59
 None
 1.09A 4qa0A-1tmoA:
undetectable		 4qa0A-1tmoA:
18.59
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.
4QA2_A_SHHA404_2
(HISTONE DEACETYLASE
8)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 PRO A  60
MET A  61
TYR A  59
 None
 0.90A 4qa2B-1tmoA:
2.8		 4qa2B-1tmoA:
17.99
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.
4U14_A_0HKA2000_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 ASP A 290
TYR A 284
THR A 251
ALA A 255
ALA A 257
 None
 1.47A 4u14A-1tmoA:
0.0		 4u14A-1tmoA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U15_A_0HKA2001_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 ASP A 290
TYR A 284
THR A 251
ALA A 255
ALA A 257
 None
 1.45A 4u15A-1tmoA:
undetectable		 4u15A-1tmoA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YVP_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 LEU A 237
TYR A 236
VAL A 223
ILE A 183
LEU A 177
 None
 1.13A 4yvpB-1tmoA:
undetectable		 4yvpB-1tmoA:
17.44
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.
4Z90_E_4LEE401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 7 LEU A 313
LEU A 242
THR A 182
THR A 316
 None
 0.90A 4z90A-1tmoA:
undetectable
4z90B-1tmoA:
undetectable
4z90C-1tmoA:
undetectable
4z90D-1tmoA:
undetectable
4z90E-1tmoA:
undetectable		 4z90A-1tmoA:
17.59
4z90B-1tmoA:
17.59
4z90C-1tmoA:
17.59
4z90D-1tmoA:
17.59
4z90E-1tmoA:
17.59
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.
4Z90_E_4LEE401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 7 THR A 316
LEU A 317
LEU A 313
THR A 182
 None
 0.92A 4z90A-1tmoA:
undetectable
4z90B-1tmoA:
undetectable
4z90C-1tmoA:
undetectable
4z90D-1tmoA:
undetectable
4z90E-1tmoA:
undetectable		 4z90A-1tmoA:
17.59
4z90B-1tmoA:
17.59
4z90C-1tmoA:
17.59
4z90D-1tmoA:
17.59
4z90E-1tmoA:
17.59
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.
5AMI_B_EF2B151_1
(CEREBLON ISOFORM 4)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 ASN A 443
PRO A 444
PHE A 439
SER A 440
 2MD  A 799 (-4.5A)
None
None
2MD  A 799 ( 4.4A)
 0.65A 5amiB-1tmoA:
undetectable		 5amiB-1tmoA:
9.59
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.
5IWU_A_ACTA402_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 6 VAL A  51
TYR A  52
MET A  21
ILE A  28
 None
 1.20A 5iwuA-1tmoA:
undetectable		 5iwuA-1tmoA:
18.03
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.
5IWU_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 ILE A 422
TYR A 431
THR A 155
SER A 769
ILE A 759
 None
 1.43A 5iwuA-1tmoA:
0.0		 5iwuA-1tmoA:
18.03
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.
5L94_A_TESA502_1
(CYTOCHROME P450)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 8 VAL A 696
ILE A 690
ALA A 685
VAL A 720
VAL A 678
 None
 1.37A 5l94A-1tmoA:
undetectable		 5l94A-1tmoA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_B_6V8B304_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.13A 5lf7V-1tmoA:
undetectable
5lf7b-1tmoA:
undetectable		 5lf7V-1tmoA:
14.23
5lf7b-1tmoA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_B_6V8B304_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 TYR A 496
THR A 487
THR A  12
ALA A  18
GLY A 122
 None
 1.06A 5lf7V-1tmoA:
undetectable
5lf7b-1tmoA:
undetectable		 5lf7V-1tmoA:
14.23
5lf7b-1tmoA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_N_6V8N305_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 THR A 474
THR A 472
ALA A 473
SER A 440
GLY A 441
 None
2MD  A 799 (-4.0A)
None
2MD  A 799 ( 4.4A)
2MD  A 799 (-3.7A)
 1.13A 5lf7H-1tmoA:
undetectable
5lf7N-1tmoA:
undetectable		 5lf7H-1tmoA:
14.23
5lf7N-1tmoA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LF7_N_6V8N305_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 TYR A 496
THR A 487
THR A  12
ALA A  18
GLY A 122
 None
 1.06A 5lf7H-1tmoA:
undetectable
5lf7N-1tmoA:
undetectable		 5lf7H-1tmoA:
14.23
5lf7N-1tmoA:
14.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MLM_A_STRA401_1
(-)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 LYS A 612
ASN A 425
ALA A 152
SER A 762
ILE A 156
 None
 1.47A 5mlmA-1tmoA:
undetectable		 5mlmA-1tmoA:
19.59
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.
5N0O_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 ALA A 152
GLN A 333
THR A 761
 None
2MD  A 800 (-3.5A)
None
 0.71A 5n0oA-1tmoA:
undetectable		 5n0oA-1tmoA:
18.21
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.
5N4T_B_BEZB306_0
(BETA-LACTAMASE VIM-2)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 HIS A 447
ASN A 446
ALA A 473
 2MD  A 799 (-4.2A)
2MD  A 799 (-3.8A)
None
 0.74A 5n4tB-1tmoA:
undetectable		 5n4tB-1tmoA:
14.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ND7_B_TA1B601_2
(TUBULIN BETA-2B
CHAIN)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		3 / 3 THR A 525
PRO A 383
ARG A 384
 None
 0.82A 5nd7B-1tmoA:
undetectable		 5nd7B-1tmoA:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NZ0_A_ZLDA301_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 GLY A  49
ILE A  47
MET A 510
THR A 486
VAL A 469
 None
 1.32A 5nz0A-1tmoA:
0.0		 5nz0A-1tmoA:
14.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XPR_A_K86A1201_2
(ENDOTHELIN B
RECEPTOR,ENDOLYSIN,E
NDOTHELIN B RECEPTOR)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 4 ASP A 189
PRO A 652
GLU A 724
TYR A 771
 None
2MD  A 800 (-4.1A)
2MD  A 799 ( 4.5A)
2MD  A 799 (-4.8A)
 1.44A 5xprA-1tmoA:
0.0		 5xprA-1tmoA:
20.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Y2T_A_8LXA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 GLN A 211
TYR A 236
LEU A 237
ILE A 183
MET A 325
 None
 1.14A 5y2tA-1tmoA:
undetectable		 5y2tA-1tmoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B94_A_W9TA201_0
(GALECTIN-1)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 HIS A 643
ASN A 700
ARG A 702
GLU A 632
 None
 1.01A 6b94A-1tmoA:
undetectable		 6b94A-1tmoA:
7.02
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.
6BZO_C_FI8C1201_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		5 / 12 THR A 104
GLN A 103
VAL A 135
SER A  98
GLU A 462
 None
 1.28A 6bzoC-1tmoA:
0.0		 6bzoC-1tmoA:
22.10
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.
6GIQ_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)		 1tmo TRIMETHYLAMINE
N-OXIDE REDUCTASE
(Shewanella
massilia) 		4 / 8 MET A  50
GLY A 441
SER A 127
VAL A 469
 None
2MD  A 799 (-3.7A)
2MD  A 799 (-3.4A)
None
 0.94A 6giqL-1tmoA:
undetectable
6giqP-1tmoA:
undetectable
6giqT-1tmoA:
undetectable		 6giqL-1tmoA:
20.64
6giqP-1tmoA:
13.75
6giqT-1tmoA:
6.20