SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5xfa'

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.
11GS_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 TYR D 308
PHE D 244
VAL D 310
GLY D 397
 None
 0.96A 11gsA-5xfaD:
undetectable		 11gsA-5xfaD:
19.53
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.
1AX9_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 GLY D 139
PHE D 232
PHE D 233
HIS D 229
 None
 0.89A 1ax9A-5xfaD:
undetectable		 1ax9A-5xfaD:
22.42
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.
1DSC_C_DVAC8_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 212
THR A 210
PRO A 209
 None
 0.81A 1dscC-5xfaA:
undetectable		 1dscC-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DTL_A_BEPA205_1
(CARDIAC TROPONIN C)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA D 458
PHE D 226
LEU D 225
LEU D 136
PHE D 140
 None
 1.17A 1dtlA-5xfaD:
undetectable		 1dtlA-5xfaD:
17.00
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.
1E7B_B_HLTB4003_1
(SERUM ALBUMIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 VAL A 365
GLY A 366
ALA A 185
LEU A 258
 None
 0.79A 1e7bB-5xfaA:
undetectable		 1e7bB-5xfaA:
22.12
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.
1EE2_B_CHDB1250_0
(ALCOHOL
DEHYDROGENASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 MET D 202
LEU D 205
SER D 206
 None
 0.45A 1ee2A-5xfaD:
undetectable		 1ee2A-5xfaD:
22.16
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.
1FJA_C_DVAC8_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 212
THR A 210
PRO A 209
 None
 0.87A 1fjaC-5xfaA:
undetectable		 1fjaC-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FJA_D_DVAD8_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 212
THR A 210
PRO A 209
 None
 0.88A 1fjaD-5xfaA:
undetectable		 1fjaD-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1IBG_H_OBNH1_2
(IGG2B-KAPPA 40-50
FAB (HEAVY CHAIN)
IGG2B-KAPPA 40-50
FAB (LIGHT CHAIN))		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 THR C  18
HIS C  28
TYR D 130
LEU D 126
 None
 1.03A 1ibgL-5xfaC:
undetectable		 1ibgL-5xfaC:
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.
1MJ2_A_SAMA2200_0
(PROTEIN (METHIONINE
REPRESSOR))		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.19A 1mj2A-5xfaA:
undetectable
1mj2B-5xfaA:
undetectable		 1mj2A-5xfaA:
9.86
1mj2B-5xfaA:
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.
1MJ2_C_SAMC2199_0
(PROTEIN (METHIONINE
REPRESSOR))		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.16A 1mj2C-5xfaA:
undetectable
1mj2D-5xfaA:
undetectable		 1mj2C-5xfaA:
9.86
1mj2D-5xfaA:
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.
1MJO_C_SAMC200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.17A 1mjoC-5xfaA:
undetectable
1mjoD-5xfaA:
undetectable		 1mjoC-5xfaA:
9.86
1mjoD-5xfaA:
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.
1MJQ_A_SAMA200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 11 LEU B 164
GLU B 169
LEU A  41
PRO A  42
GLY A 328
 None
 1.23A 1mjqA-5xfaB:
undetectable
1mjqB-5xfaB:
undetectable		 1mjqA-5xfaB:
19.31
1mjqB-5xfaB:
19.31
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.
1MJQ_B_SAMB200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 11 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.14A 1mjqA-5xfaA:
undetectable
1mjqB-5xfaA:
undetectable		 1mjqA-5xfaA:
9.86
1mjqB-5xfaA:
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.
1MJQ_C_SAMC199_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 10 LEU B 164
GLU B 169
LEU A  41
PRO A  42
GLY A 328
 None
 1.22A 1mjqC-5xfaB:
undetectable
1mjqD-5xfaB:
undetectable		 1mjqC-5xfaB:
19.31
1mjqD-5xfaB:
19.31
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.
1MJQ_D_SAMD200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA C  96
GLY C  99
GLU C  67
ALA C  91
PRO C 161
 None
None
SF4  C 201 ( 3.6A)
None
None
 1.13A 1mjqC-5xfaC:
undetectable
1mjqD-5xfaC:
undetectable		 1mjqC-5xfaC:
21.08
1mjqD-5xfaC:
21.08
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.
1MJQ_G_SAMG199_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 10 GLU C  67
ALA C  91
PRO C 161
ALA C  96
GLY C  99
 SF4  C 201 ( 3.6A)
None
None
None
None
 1.13A 1mjqG-5xfaC:
undetectable
1mjqH-5xfaC:
undetectable		 1mjqG-5xfaC:
21.08
1mjqH-5xfaC:
21.08
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.
1MJQ_H_SAMH200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 10 GLY A 328
LEU B 164
GLU B 169
LEU A  41
PRO A  42
 None
 1.13A 1mjqG-5xfaA:
undetectable
1mjqH-5xfaA:
undetectable		 1mjqG-5xfaA:
9.86
1mjqH-5xfaA:
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.
1MJQ_I_SAMI199_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 11 LEU B 164
GLU B 169
LEU A  41
PRO A  42
GLY A 328
 None
 1.21A 1mjqI-5xfaB:
undetectable
1mjqJ-5xfaB:
undetectable		 1mjqI-5xfaB:
19.31
1mjqJ-5xfaB:
19.31
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.
1MJQ_J_SAMJ200_0
(METHIONINE REPRESSOR)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA C  96
GLY C  99
GLU C  67
ALA C  91
PRO C 161
 None
None
SF4  C 201 ( 3.6A)
None
None
 1.12A 1mjqI-5xfaC:
undetectable
1mjqJ-5xfaC:
undetectable		 1mjqI-5xfaC:
21.08
1mjqJ-5xfaC:
21.08
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.
1MT1_B_AG2B7001_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 GLU D 356
ARG D 113
LEU D 253
ASP D 254
 None
 0.89A 1mt1B-5xfaD:
undetectable
1mt1C-5xfaD:
undetectable		 1mt1B-5xfaD:
13.46
1mt1C-5xfaD:
8.62
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.
1QAB_F_RTLF2_0
(PROTEIN (RETINOL
BINDING PROTEIN))		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA A 531
ALA A 471
LEU A 550
GLY A 532
MET A 519
 None
 1.16A 1qabF-5xfaA:
undetectable		 1qabF-5xfaA:
14.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V54_J_CHDJ3060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.93A 1v54A-5xfaA:
undetectable
1v54J-5xfaA:
undetectable		 1v54A-5xfaA:
22.80
1v54J-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V54_W_CHDW4060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.90A 1v54N-5xfaA:
2.7
1v54W-5xfaA:
undetectable		 1v54N-5xfaA:
22.80
1v54W-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_B_ACTB294_0
(GLYCINE
N-METHYLTRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 ALA D 176
GLU D 175
ILE D 174
LEU D 204
 None
 0.95A 1xvaA-5xfaD:
undetectable
1xvaB-5xfaD:
undetectable		 1xvaA-5xfaD:
20.08
1xvaB-5xfaD:
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.
1Y7I_A_SALA501_1
(SALICYLIC
ACID-BINDING PROTEIN
2)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 9 GLY C  23
SER C  20
LEU C  21
LEU C  79
HIS C  28
 SF4  C 201 (-3.5A)
None
None
None
None
 1.35A 1y7iA-5xfaC:
undetectable		 1y7iA-5xfaC:
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.
209D_C_DVAC8_0
(N8-ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 212
THR A 210
PRO A 209
 None
 0.82A 209dC-5xfaA:
undetectable		 209dC-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AOF_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 LEU D 399
PRO D 395
ALA D 394
ILE D 392
 FCO  D 501 (-3.3A)
FCO  D 501 ( 3.8A)
FCO  D 501 (-3.6A)
None
 0.98A 2aofB-5xfaD:
undetectable		 2aofB-5xfaD:
12.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AXN_A_EDTA737_0
(6-PHOSPHOFRUCTO-2-KI
NASE/FRUCTOSE-2,6-BI
PHOSPHATASE 3
(6PF-2-K/FRU-
2,6-P2ASE
BRAIN/PLACENTA-TYPE
ISOZYME) (IPFK-2)
[INCLUDES: 6-
PHOSPHOFRUCTO-2-KINA
SE (EC 2.7.1.105)
FRUCTOSE-2,6-BISPHO
SPHATASE (EC
3.1.3.46)])		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 PRO A 552
GLY A 502
PHE A 584
ALA A 504
THR A 505
 None
 1.27A 2axnA-5xfaA:
undetectable		 2axnA-5xfaA:
20.48
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.
2BXC_B_P1ZB2001_1
(SERUM ALBUMIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 9 LEU A 581
LEU C 140
HIS C 144
ALA A 567
ALA A 563
 None
 1.29A 2bxcB-5xfaA:
undetectable		 2bxcB-5xfaA:
22.12
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.
2BXE_B_1FLB2002_1
(SERUM ALBUMIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		6 / 11 PHE A  56
ALA A  50
ALA A  47
LEU A  32
ALA A  29
LEU A  16
 None
 1.49A 2bxeB-5xfaA:
2.1		 2bxeB-5xfaA:
22.12
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.
2CIZ_A_ACTA1321_0
(CHLOROPEROXIDASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 LEU B  71
PHE B  13
VAL B  59
ALA B  61
 None
 1.18A 2cizA-5xfaB:
undetectable		 2cizA-5xfaB:
22.67
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.
2D55_C_DVAC2_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 342
PRO A 340
PRO A 349
 None
 0.77A 2d55C-5xfaA:
undetectable		 2d55C-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2D55_C_DVAC8_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 PRO A 340
THR A 350
PRO A 349
 None
 0.75A 2d55C-5xfaA:
undetectable		 2d55C-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2D55_C_DVAC8_0
(ACTINOMYCIN D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 PRO A 349
THR A 342
PRO A 340
 None
 0.76A 2d55C-5xfaA:
undetectable		 2d55C-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYR_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.97A 2dyrA-5xfaA:
undetectable
2dyrJ-5xfaA:
undetectable		 2dyrA-5xfaA:
22.80
2dyrJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYR_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.95A 2dyrN-5xfaA:
1.9
2dyrW-5xfaA:
undetectable		 2dyrN-5xfaA:
22.80
2dyrW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYS_J_CHDJ101_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 1.01A 2dysA-5xfaA:
undetectable
2dysJ-5xfaA:
undetectable		 2dysA-5xfaA:
22.80
2dysJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYS_W_CHDW101_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.89A 2dysN-5xfaA:
undetectable
2dysW-5xfaA:
undetectable		 2dysN-5xfaA:
22.80
2dysW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.94A 2eijA-5xfaA:
undetectable
2eijJ-5xfaA:
undetectable		 2eijA-5xfaA:
22.80
2eijJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.84A 2eijN-5xfaA:
2.1
2eijW-5xfaA:
undetectable		 2eijN-5xfaA:
22.80
2eijW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIK_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.94A 2eikA-5xfaA:
undetectable
2eikJ-5xfaA:
undetectable		 2eikA-5xfaA:
22.80
2eikJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIK_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.85A 2eikN-5xfaA:
undetectable
2eikW-5xfaA:
undetectable		 2eikN-5xfaA:
22.80
2eikW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.93A 2eilA-5xfaA:
2.7
2eilJ-5xfaA:
undetectable		 2eilA-5xfaA:
22.80
2eilJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.88A 2eilN-5xfaA:
undetectable
2eilW-5xfaA:
undetectable		 2eilN-5xfaA:
22.80
2eilW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_J_TACJ5888_1
(ELONGATION FACTOR
EF-TU)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 THR A 453
SER A 113
PRO A 236
VAL A  71
 None
 1.13A 2hdnI-5xfaA:
undetectable
2hdnJ-5xfaA:
2.4
2hdnL-5xfaA:
undetectable		 2hdnI-5xfaA:
5.48
2hdnJ-5xfaA:
20.27
2hdnL-5xfaA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HDN_L_TACL6888_1
(ELONGATION FACTOR
EF-TU)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 VAL A  71
THR A 453
SER A 113
PRO A 236
 None
 1.13A 2hdnJ-5xfaA:
2.4
2hdnK-5xfaA:
undetectable
2hdnL-5xfaA:
undetectable		 2hdnJ-5xfaA:
20.27
2hdnK-5xfaA:
5.48
2hdnL-5xfaA:
20.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2LBD_A_REAA500_1
(RETINOIC ACID
RECEPTOR GAMMA)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 CYH B 159
LEU B 171
ILE B 173
GLY A  44
LEU A  41
 SF4  B 302 (-2.2A)
None
None
None
None
 1.20A 2lbdA-5xfaB:
undetectable		 2lbdA-5xfaB:
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.
2NYR_B_SVRB401_4
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 ALA D 458
ALA D 434
ALA D 435
VAL D  37
 None
 0.89A 2nyrB-5xfaD:
undetectable		 2nyrB-5xfaD:
20.72
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.
2Q64_B_1UNB1001_4
(PROTEASE RETROPEPSIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 ASP A  69
THR A  58
PRO A  59
 None
 0.39A 2q64B-5xfaA:
undetectable		 2q64B-5xfaA:
11.01
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.
2QX6_B_ML1B233_1
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 GLY C 100
GLY C  23
PHE D  60
PHE D  63
 None
SF4  C 201 (-3.5A)
None
None
 1.03A 2qx6A-5xfaC:
2.6
2qx6B-5xfaC:
2.3		 2qx6A-5xfaC:
21.03
2qx6B-5xfaC:
21.03
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.
2RLF_C_RIMC399_1
(MATRIX PROTEIN 2)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 168
LEU A 171
ASP A 172
ILE A 161
 None
 0.92A 2rlfC-5xfaA:
undetectable
2rlfD-5xfaA:
undetectable		 2rlfC-5xfaA:
6.26
2rlfD-5xfaA:
6.26
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.
2V32_A_BEZA1222_0
(PEROXIREDOXIN 6)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 THR A 377
PRO A 378
SER A 380
ALA A 447
 None
 0.96A 2v32A-5xfaA:
undetectable
2v32B-5xfaA:
undetectable		 2v32A-5xfaA:
17.09
2v32B-5xfaA:
17.09
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.
2V32_C_BEZC1222_0
(PEROXIREDOXIN 6)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 PRO D 395
PRO D  84
VAL D  85
SER D  86
 FCO  D 501 ( 3.8A)
None
None
None
 0.53A 2v32C-5xfaD:
undetectable
2v32D-5xfaD:
undetectable		 2v32C-5xfaD:
19.36
2v32D-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V32_D_BEZD1221_0
(PEROXIREDOXIN 6)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 VAL D 188
PRO D 189
PRO D  73
VAL D  74
 None
 0.78A 2v32C-5xfaD:
undetectable
2v32D-5xfaD:
undetectable		 2v32C-5xfaD:
19.36
2v32D-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V41_C_BEZC1218_0
(PEROXIREDOXIN 6.)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 PRO D 395
PRO D  84
VAL D  85
SER D  86
 FCO  D 501 ( 3.8A)
None
None
None
 0.49A 2v41C-5xfaD:
undetectable
2v41D-5xfaD:
undetectable		 2v41C-5xfaD:
19.36
2v41D-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V41_D_BEZD1222_0
(PEROXIREDOXIN 6.)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 PRO D 395
PRO D  84
VAL D  85
SER D  86
 FCO  D 501 ( 3.8A)
None
None
None
 0.55A 2v41C-5xfaD:
undetectable
2v41D-5xfaD:
undetectable		 2v41C-5xfaD:
19.36
2v41D-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V41_G_BEZG1222_0
(PEROXIREDOXIN 6.)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 VAL D 120
SER D 123
ALA D 394
PRO D 312
 None
None
FCO  D 501 (-3.6A)
None
 1.10A 2v41G-5xfaD:
undetectable
2v41H-5xfaD:
undetectable		 2v41G-5xfaD:
19.36
2v41H-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2V41_H_BEZH1222_0
(PEROXIREDOXIN 6.)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 PRO D 395
PRO D  84
VAL D  85
SER D  86
 FCO  D 501 ( 3.8A)
None
None
None
 0.53A 2v41G-5xfaD:
undetectable
2v41H-5xfaD:
undetectable		 2v41G-5xfaD:
19.36
2v41H-5xfaD:
19.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W9G_A_TOPA1159_1
(DIHYDROFOLATE
REDUCTASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 10 LEU A 227
LEU A 358
VAL A 361
ILE A 257
THR A 210
 None
 0.98A 2w9gA-5xfaA:
undetectable		 2w9gA-5xfaA:
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.
2W9H_A_TOPA1160_1
(DIHYDROFOLATE
REDUCTASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 10 LEU A 227
LEU A 358
VAL A 361
ILE A 257
THR A 210
 None
 1.08A 2w9hA-5xfaA:
undetectable		 2w9hA-5xfaA:
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.
2XNR_A_ACTA1001_0
(NUCLEAR
POLYADENYLATED
RNA-BINDING PROTEIN
3)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 SER D 123
ARG D 167
GLN D 122
 None
 0.93A 2xnrA-5xfaD:
undetectable		 2xnrA-5xfaD:
9.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZIF_B_SAMB298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA D 178
SER D  86
PRO D  84
PRO D 395
GLY D 118
 None
None
None
FCO  D 501 ( 3.8A)
None
 1.03A 2zifB-5xfaD:
undetectable		 2zifB-5xfaD:
23.43
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.
2ZXW_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 1.07A 2zxwA-5xfaA:
undetectable
2zxwJ-5xfaA:
undetectable		 2zxwA-5xfaA:
22.80
2zxwJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
316D_C_DVAC2_0
(8-FLUORO-ACTINOMYCIN
D)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 THR A 210
PRO A 209
THR A 212
 None
 0.90A 316dC-5xfaA:
undetectable		 316dC-5xfaA:
2.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABL_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.84A 3ablN-5xfaA:
2.3
3ablW-5xfaA:
undetectable		 3ablN-5xfaA:
22.80
3ablW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 1.01A 3abmA-5xfaA:
2.2
3abmJ-5xfaA:
undetectable		 3abmA-5xfaA:
22.80
3abmJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 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_A_IMNA2_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 GLN D 281
HIS D 402
TYR D 413
HIS C 123
TYR D 279
 None
 1.34A 3adxA-5xfaD:
undetectable		 3adxA-5xfaD:
21.70
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.
3ASN_J_CHDJ60_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.97A 3asnA-5xfaA:
undetectable
3asnJ-5xfaA:
undetectable		 3asnA-5xfaA:
22.80
3asnJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASN_W_CHDW1059_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.92A 3asnN-5xfaA:
undetectable
3asnW-5xfaA:
undetectable		 3asnN-5xfaA:
22.80
3asnW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ASO_J_CHDJ60_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.97A 3asoA-5xfaA:
undetectable
3asoJ-5xfaA:
undetectable		 3asoA-5xfaA:
22.80
3asoJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3CR4_X_PNTX101_0
(PROTEIN S100-B)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 CYH B 105
HIS B 103
PHE B 104
 SF4  B 301 (-2.3A)
SF4  B 301 (-3.2A)
None
 1.23A 3cr4X-5xfaB:
undetectable		 3cr4X-5xfaB:
16.74
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.
3EL4_A_ROCA100_2
(PROTEASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 9 ALA D 187
VAL D  85
ILE D 174
GLY D 179
ILE B 222
 None
 1.25A 3el4B-5xfaD:
undetectable		 3el4B-5xfaD:
12.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FL9_B_TOPB200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 LEU A 227
LEU A 358
VAL A 361
ILE A 257
THR A 210
 None
 1.08A 3fl9B-5xfaA:
undetectable		 3fl9B-5xfaA:
12.35
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.
3FL9_E_TOPE200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 10 LEU A 227
LEU A 358
VAL A 361
ILE A 257
THR A 210
 None
 0.98A 3fl9E-5xfaA:
undetectable		 3fl9E-5xfaA:
12.35
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.
3FRB_X_TOPX300_1
(DIHYDROFOLATE
REDUCTASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 11 LEU A 227
LEU A 358
VAL A 361
ILE A 257
THR A 210
 None
 1.02A 3frbX-5xfaA:
undetectable		 3frbX-5xfaA:
13.18
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.
3HBB_A_TMQA611_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 10 VAL C 165
ASP C 172
ILE C  16
LEU C  65
ILE C 166
 None
 1.14A 3hbbA-5xfaC:
undetectable		 3hbbA-5xfaC:
19.53
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.
3JUS_B_ECNB602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 9 LEU D 131
PHE C  47
GLY D 151
ALA D 153
ILE D 164
 None
 1.19A 3jusB-5xfaD:
undetectable		 3jusB-5xfaD:
22.87
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.
3JW5_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 11 ALA D  90
ASN D 415
LEU D 416
LEU D  79
ILE D  64
 None
MG  D 503 ( 4.6A)
None
None
None
 1.30A 3jw5A-5xfaD:
undetectable		 3jw5A-5xfaD:
14.32
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.
3M0W_B_P77B204_1
(PROTEIN S100-A4)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 CYH A 316
GLU A 318
PHE A 527
PHE A 473
 None
None
SF4  A 601 ( 4.5A)
None
 1.37A 3m0wB-5xfaA:
undetectable
3m0wJ-5xfaA:
undetectable		 3m0wB-5xfaA:
9.22
3m0wJ-5xfaA:
9.22
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.
3MJR_D_AC2D601_1
(DEOXYCYTIDINE KINASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 TYR A 314
PHE A 474
ARG A 536
ASP A 537
 None
 1.07A 3mjrD-5xfaA:
undetectable		 3mjrD-5xfaA:
17.43
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.
3OKX_A_SAMA201_1
(YAEB-LIKE PROTEIN
RPA0152)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 HIS A  66
ARG A 128
ASP A  73
THR A 107
 None
 1.46A 3okxA-5xfaA:
undetectable		 3okxA-5xfaA:
16.42
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.
3OKX_B_SAMB201_2
(YAEB-LIKE PROTEIN
RPA0152)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 HIS A  66
ARG A 128
ASP A  73
THR A 107
 None
 1.47A 3okxB-5xfaA:
undetectable		 3okxB-5xfaA:
16.42
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.
3R9C_A_ECLA452_1
(CYTOCHROME P450
164A2)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 LEU A 272
LEU A 283
VAL A 359
ALA A 231
ASN A 230
 None
 1.11A 3r9cA-5xfaA:
undetectable		 3r9cA-5xfaA:
24.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQ4_A_SAMA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H2)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLU C  67
GLY C  68
SER C  30
CYH D 462
CYH D 465
 SF4  C 201 ( 3.6A)
SF4  C 201 ( 4.5A)
None
NI  D 502 ( 2.3A)
FCO  D 501 ( 2.3A)
 1.17A 3rq4A-5xfaC:
undetectable		 3rq4A-5xfaC:
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.
3S8P_B_SAMB500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLU C  67
GLY C  68
SER C  30
CYH D 462
CYH D 465
 SF4  C 201 ( 3.6A)
SF4  C 201 ( 4.5A)
None
NI  D 502 ( 2.3A)
FCO  D 501 ( 2.3A)
 1.20A 3s8pB-5xfaC:
undetectable		 3s8pB-5xfaC:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SI7_C_ACTC4_0
(CYSTIC FIBROSIS
TRANSMEMBRANE
CONDUCTANCE
REGULATOR)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 4 GLY A  11
GLY A 328
THR A   8
LEU A 346
 None
 0.89A 3si7C-5xfaA:
undetectable
3si7D-5xfaA:
undetectable		 3si7C-5xfaA:
18.23
3si7D-5xfaA:
18.23
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.
3TKG_C_ROCC901_3
(PROTEASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 ASP A  69
THR A  58
PRO A  59
 None
 0.38A 3tkgD-5xfaA:
undetectable		 3tkgD-5xfaA:
13.92
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.
3TWP_B_SALB404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 ALA C 103
PRO C 102
ARG D  78
ALA C  94
 None
None
None
SF4  C 201 (-3.9A)
 1.00A 3twpB-5xfaC:
undetectable		 3twpB-5xfaC:
19.00
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.
3U5J_A_08HA1_1
(BROMODOMAIN-CONTAINI
NG PROTEIN 4)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 102
ASN A 122
ILE A 121
MET A 126
 None
 0.90A 3u5jA-5xfaA:
undetectable		 3u5jA-5xfaA:
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.
3VM4_A_IZPA1_1
(FATTY ACID
ALPHA-HYDROXYLASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 LEU D 253
ARG D 315
PRO D 312
ALA D 314
 None
 1.46A 3vm4A-5xfaD:
undetectable		 3vm4A-5xfaD:
23.29
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.
4ACA_B_DXCB1473_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 9 ILE D  82
GLY D  81
VAL D  31
GLY D  33
ARG C  49
 None
 1.26A 4acaB-5xfaD:
undetectable
4acaC-5xfaD:
undetectable		 4acaB-5xfaD:
22.88
4acaC-5xfaD:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BUP_A_SAMA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLU C  67
GLY C  68
SER C  30
CYH D 462
CYH D 465
 SF4  C 201 ( 3.6A)
SF4  C 201 ( 4.5A)
None
NI  D 502 ( 2.3A)
FCO  D 501 ( 2.3A)
 1.18A 4bupA-5xfaC:
undetectable		 4bupA-5xfaC:
21.66
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.
4FGZ_B_CQAB301_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 GLY A 234
GLY A 111
GLU A 275
LEU A 112
 None
 0.85A 4fgzB-5xfaA:
undetectable		 4fgzB-5xfaA:
16.61
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.
4J6D_A_TESA503_1
(CYTOCHROME P450
MONOOXYGENASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 PHE D 128
PHE D 129
ALA D 220
ALA D 218
ALA D 217
 None
 1.10A 4j6dA-5xfaD:
undetectable		 4j6dA-5xfaD:
23.25
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.
4J6D_B_TESB502_1
(CYTOCHROME P450
MONOOXYGENASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 PHE D 128
PHE D 129
ALA D 220
ALA D 218
ALA D 217
 None
 1.11A 4j6dB-5xfaD:
undetectable		 4j6dB-5xfaD:
23.25
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.
4JBT_A_ASDA501_1
(CYTOCHROME P450
MONOOXYGENASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 PHE D 128
PHE D 129
ALA D 220
ALA D 218
ALA D 217
 None
 1.09A 4jbtA-5xfaD:
undetectable		 4jbtA-5xfaD:
23.25
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.
4MJ8_B_SPMB201_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 MET D 111
GLU D 374
GLU D 200
ARG D 198
 None
 1.17A 4mj8B-5xfaD:
undetectable
4mj8C-5xfaD:
undetectable		 4mj8B-5xfaD:
17.22
4mj8C-5xfaD:
17.22
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.
4O1E_A_C2FA3000_0
(DIHYDROPTEROATE
SYNTHASE DHPS)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 ILE A 492
LEU B 155
GLY B 177
SER A 478
ILE B 178
 None
None
None
SF4  A 601 (-3.5A)
None
 1.20A 4o1eA-5xfaA:
undetectable		 4o1eA-5xfaA:
21.34
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.
4RZV_B_032B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 PHE B 227
SER D 186
HIS D  88
ASP C 189
 None
 1.42A 4rzvB-5xfaB:
undetectable		 4rzvB-5xfaB:
22.12
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.
4WH5_A_3QBA204_1
(LINCOSAMIDE
RESISTANCE PROTEIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 GLY A 366
HIS A 251
ALA A 185
PHE A 180
HIS A 182
 None
 1.34A 4wh5A-5xfaA:
undetectable		 4wh5A-5xfaA:
13.03
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.
4XR4_B_AG2B511_1
(HOMOSPERMIDINE
SYNTHASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 VAL C 130
PHE D  57
ARG C 105
 None
 0.98A 4xr4B-5xfaC:
3.5		 4xr4B-5xfaC:
17.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZBQ_A_DIFA601_1
(SERUM ALBUMIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 11 LEU D 165
VAL D 166
LEU D 204
ARG D 207
GLY D 118
 None
 1.28A 4zbqA-5xfaD:
undetectable		 4zbqA-5xfaD:
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.
5B1B_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.95A 5b1bA-5xfaA:
2.8
5b1bJ-5xfaA:
undetectable		 5b1bA-5xfaA:
22.80
5b1bJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1B_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 PHE C  47
ARG C  37
THR C 171
LEU C 174
 None
 0.87A 5b1bN-5xfaC:
undetectable
5b1bW-5xfaC:
undetectable		 5b1bN-5xfaC:
17.32
5b1bW-5xfaC:
16.15
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.
5CPR_B_SAMB402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SUV420H1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		5 / 12 GLU C  67
GLY C  68
SER C  30
CYH D 462
CYH D 465
 SF4  C 201 ( 3.6A)
SF4  C 201 ( 4.5A)
None
NI  D 502 ( 2.3A)
FCO  D 501 ( 2.3A)
 1.24A 5cprB-5xfaC:
undetectable		 5cprB-5xfaC:
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.
5EYP_B_LOCB502_2
(TUBULIN BETA CHAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA A 185
THR A 174
ALA A 176
ILE A 290
ALA A 293
 None
 0.99A 5eypB-5xfaA:
undetectable		 5eypB-5xfaA:
20.29
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.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ARG A 574
THR A 568
PHE C 118
LEU C 114
THR D 467
 None
 1.47A 5fhzA-5xfaA:
3.0		 5fhzA-5xfaA:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GWZ_D_010D6_0
(N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE
PEDV MAIN PROTEASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 MET D 115
HIS D  88
GLY D 179
 None
 0.80A 5gwzB-5xfaD:
undetectable		 5gwzB-5xfaD:
22.29
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.
5HFJ_C_SAMC301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA D 458
THR D 243
PHE D 459
GLY D 311
THR D 398
 None
 1.30A 5hfjC-5xfaD:
undetectable		 5hfjC-5xfaD:
16.67
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.
5HPU_C_IPHC101_0
(INSULIN, CHAIN A
INSULIN, CHAIN B)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU D 399
CYH D 414
HIS D 402
LEU D 416
 FCO  D 501 (-3.3A)
None
None
None
 1.03A 5hpuC-5xfaD:
undetectable
5hpuD-5xfaD:
undetectable		 5hpuC-5xfaD:
4.96
5hpuD-5xfaD:
12.77
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.
5HRQ_A_IPHA101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 CYH B  69
CYH B  57
HIS B  45
HIS B  41
 FES  B 303 (-2.3A)
FES  B 303 (-2.2A)
None
None
 1.47A 5hrqA-5xfaB:
undetectable
5hrqB-5xfaB:
undetectable
5hrqF-5xfaB:
undetectable		 5hrqA-5xfaB:
6.91
5hrqB-5xfaB:
11.31
5hrqF-5xfaB:
11.31
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.
5IY5_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.89A 5iy5A-5xfaA:
undetectable
5iy5J-5xfaA:
undetectable		 5iy5A-5xfaA:
22.80
5iy5J-5xfaA:
7.22
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.
5M50_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 VAL A 392
THR A 430
GLN A 438
GLY A 407
LEU A 406
 None
 1.26A 5m50B-5xfaA:
undetectable		 5m50B-5xfaA:
20.23
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.
5M50_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 VAL A 392
THR A 430
GLN A 438
GLY A 407
LEU A 406
 None
 1.29A 5m50E-5xfaA:
undetectable		 5m50E-5xfaA:
20.23
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.
5N0O_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ILE A 290
VAL A 297
SER A 292
ALA A 176
VAL A 179
 None
 1.18A 5n0oA-5xfaA:
undetectable		 5n0oA-5xfaA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 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_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ILE A 290
VAL A 297
SER A 292
ALA A 176
VAL A 179
 None
 1.17A 5n0sB-5xfaA:
undetectable		 5n0sB-5xfaA:
21.12
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.
5N1T_W_CUW201_0
(COPC)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 HIS A 469
ASP A  69
HIS A  74
 None
 0.86A 5n1tW-5xfaA:
undetectable		 5n1tW-5xfaA:
16.44
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.
5N9X_A_THRA601_0
(ADENYLATION DOMAIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 ASP A 458
PHE A 457
GLY A 390
HIS A  75
 None
 0.92A 5n9xA-5xfaA:
undetectable		 5n9xA-5xfaA:
24.76
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.
5NN8_A_ACRA1015_1
(LYSOSOMAL
ALPHA-GLUCOSIDASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 LEU D 410
ILE B 139
ASP B 149
ARG B 152
LEU C 101
 None
 1.28A 5nn8A-5xfaD:
undetectable		 5nn8A-5xfaD:
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.
5OM3_B_DXTB501_1
(ALPHA-1-ANTICHYMOTRY
PSIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 561
SER A 560
PHE A 559
HIS C 142
 None
 0.77A 5om3A-5xfaA:
undetectable
5om3B-5xfaA:
undetectable		 5om3A-5xfaA:
8.64
5om3B-5xfaA:
4.72
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.
5TDM_A_ADNA904_1
(ATP-CITRATE SYNTHASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 4 THR A 495
ASP A 508
ARG A 511
LEU A 512
 None
 1.05A 5tdmA-5xfaA:
2.2		 5tdmA-5xfaA:
20.20
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.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 THR A 495
ASP A 508
ARG A 511
LEU A 512
 None
 1.06A 5tdzA-5xfaA:
2.1		 5tdzA-5xfaA:
20.20
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.
5UUN_A_ACTA310_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 GLU B  47
HIS B  45
ARG B 161
 None
 0.89A 5uunA-5xfaB:
undetectable		 5uunA-5xfaB:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VCG_A_08YA602_2
(CYTOCHROME P450 3A4)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		3 / 3 ARG A 332
ARG B 161
ARG B  55
 None
None
FES  B 303 (-4.8A)
 1.02A 5vcgA-5xfaA:
undetectable		 5vcgA-5xfaA:
21.55
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.
5VEU_H_RITH602_1
(CYTOCHROME P450 3A5)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 SER C  30
GLY C  99
ILE C 166
THR C  18
GLY C  69
 None
 0.98A 5veuH-5xfaC:
undetectable		 5veuH-5xfaC:
17.12
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.
5X1F_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 1.06A 5x1fA-5xfaA:
undetectable
5x1fJ-5xfaA:
undetectable		 5x1fA-5xfaA:
22.80
5x1fJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X80_B_SALB203_1
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 GLY D 348
TYR D 349
LEU D 136
ARG D 353
 None
 0.98A 5x80A-5xfaD:
undetectable
5x80B-5xfaD:
undetectable		 5x80A-5xfaD:
17.14
5x80B-5xfaD:
17.14
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.
5XDX_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 8 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.89A 5xdxN-5xfaA:
2.0
5xdxW-5xfaA:
undetectable		 5xdxN-5xfaA:
22.80
5xdxW-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XXI_A_LSNA501_1
(CYTOCHROME P450 2C9)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		5 / 12 ALA A 194
VAL A 179
GLY A 255
ALA A 254
LEU A 171
 None
 1.01A 5xxiA-5xfaA:
undetectable		 5xxiA-5xfaA:
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		4 / 6 PHE A 559
VAL C  70
LEU A 581
LEU A 561
 None
 1.00A 6e43A-5xfaA:
undetectable		 6e43A-5xfaA:
20.99
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		4 / 6 PHE A 559
VAL C  70
LEU A 581
LEU A 561
 None
 0.98A 6e43B-5xfaA:
undetectable		 6e43B-5xfaA:
20.99
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.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		4 / 6 PHE A 559
VAL C  70
LEU A 581
LEU A 561
 None
 1.01A 6e43C-5xfaA:
undetectable		 6e43C-5xfaA:
20.99
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.
6E43_D_BEZD502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 5xfa NAD-REDUCING
HYDROGENASE
NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus;
Hydrogenophilus
thermoluteolus) 		4 / 6 PHE A 559
VAL C  70
LEU A 581
LEU A 561
 None
 0.97A 6e43D-5xfaA:
undetectable		 6e43D-5xfaA:
20.99
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.
6MA6_A_MYTA603_0
(CYTOCHROME P450 3A4)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 6 ARG D 309
ARG D 353
ALA D 352
ALA D 458
 None
 1.13A 6ma6A-5xfaD:
undetectable		 6ma6A-5xfaD:
10.13
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.
6NMF_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 7 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.95A 6nmfA-5xfaA:
undetectable
6nmfJ-5xfaA:
undetectable		 6nmfA-5xfaA:
22.80
6nmfJ-5xfaA:
6.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NMP_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 5xfa NAD-REDUCING
HYDROGENASE
(Hydrogenophilus
thermoluteolus) 		4 / 5 LEU A 538
ARG A 511
THR A 505
LEU A 550
 None
 0.88A 6nmpN-5xfaA:
2.6
6nmpW-5xfaA:
undetectable		 6nmpN-5xfaA:
22.80
6nmpW-5xfaA:
6.90