SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4c1n'

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.
1AJ6_A_NOVA1_1
(GYRASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 9 GLU B  52
ARG B 293
ILE B 246
ALA B 212
ILE B 210
None
1.09A 1aj6A-4c1nB:
undetectable
1aj6A-4c1nB:
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.
1D4F_C_ADNC603_1
(S-ADENOSYLHOMOCYSTEI
NE HYDROLASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.36A 1d4fC-4c1nB:
undetectable
1d4fC-4c1nB:
23.04
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.
1GTF_E_TRPE81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN
(TRAP))
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 9 GLY I 355
ALA I 322
THR I 299
THR I 302
ILE I 308
None
1.14A 1gtfD-4c1nI:
undetectable
1gtfE-4c1nI:
undetectable
1gtfD-4c1nI:
10.47
1gtfE-4c1nI:
10.47
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.
1KIA_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY B 129
VAL B  96
ASP B  55
SER B 156
LEU B  19
None
1.27A 1kiaD-4c1nB:
undetectable
1kiaD-4c1nB:
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.
1LII_A_ADNA699_1
(ADENOSINE KINASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE I 450
LEU I 559
GLY I 448
GLY I 446
LEU I 558
None
0.98A 1liiA-4c1nI:
undetectable
1liiA-4c1nI:
22.99
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.
1N13_L_AG2L7014_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE BETA
CHAIN
PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE ALPHA
CHAIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT
CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 LEU A 301
LEU A 308
ILE B 217
GLU B 255
None
1.05A 1n13I-4c1nA:
undetectable
1n13L-4c1nA:
undetectable
1n13I-4c1nA:
9.74
1n13L-4c1nA:
13.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PW7_A_RABA645_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 10 SER I 359
GLY I 297
SER I 574
ASP I 212
ILE I 213
None
1.26A 1pw7A-4c1nI:
undetectable
1pw7A-4c1nI:
19.10
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.
1Q8J_B_C2FB802_0
(5-METHYLTETRAHYDROFO
LATE S-HOMOCYSTEINE
METHYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 244
ILE I 345
GLY I 297
ASN I 298
ILE I 213
None
1.16A 1q8jB-4c1nI:
undetectable
1q8jB-4c1nI:
23.92
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.
1R9O_A_FLPA501_1
(CYTOCHROME P450 2C9)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE A 229
LEU A 230
VAL A  61
GLY A 288
ALA A 287
None
1.08A 1r9oA-4c1nA:
undetectable
1r9oA-4c1nA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RJD_A_SAMA801_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE A 159
ALA A 146
GLY A 162
GLY A 135
LEU A 167
None
1.06A 1rjdA-4c1nA:
undetectable
1rjdA-4c1nA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RJD_B_SAMB802_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE A 159
ALA A 146
GLY A 162
GLY A 135
LEU A 167
None
1.07A 1rjdB-4c1nA:
undetectable
1rjdB-4c1nA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RJD_C_SAMC803_0
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE A 159
ALA A 146
GLY A 162
GLY A 135
LEU A 167
None
1.04A 1rjdC-4c1nA:
undetectable
1rjdC-4c1nA:
21.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S9P_B_DESB459_2
(ESTROGEN-RELATED
RECEPTOR GAMMA)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT
CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
3 / 3 LEU B 309
HIS B 304
ILE A 237
None
0.47A 1s9pB-4c1nB:
undetectable
1s9pB-4c1nB:
23.20
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.
1SA1_B_PODB700_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 VAL B 243
CYH B  83
ALA B  88
ALA B  92
VAL B  53
None
1.03A 1sa1A-4c1nB:
undetectable
1sa1B-4c1nB:
undetectable
1sa1A-4c1nB:
22.32
1sa1B-4c1nB:
21.88
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.
1SA1_D_PODD701_1
(TUBULIN ALPHA CHAIN
TUBULIN BETA CHAIN)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 VAL B 243
CYH B  83
ALA B  88
ALA B  92
VAL B  53
None
1.00A 1sa1C-4c1nB:
undetectable
1sa1D-4c1nB:
undetectable
1sa1C-4c1nB:
22.32
1sa1D-4c1nB:
21.88
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.
1TV8_A_SAMA1501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 TYR I 547
THR I 216
THR I 217
MET I 415
None
1.01A 1tv8A-4c1nI:
undetectable
1tv8A-4c1nI:
21.77
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.
1UPF_A_URFA999_1
(URACIL
PHOSPHORIBOSYLTRANSF
ERASE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 ALA A 132
TYR A 182
ILE A 159
ASP A 231
None
1.26A 1upfA-4c1nA:
undetectable
1upfA-4c1nA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_A_ACTA294_0
(GLYCINE
N-METHYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 5 ILE I 562
LEU I 525
ALA I 534
GLU I 533
None
1.13A 1xvaA-4c1nI:
undetectable
1xvaB-4c1nI:
undetectable
1xvaA-4c1nI:
19.69
1xvaB-4c1nI:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_B_ACTB294_0
(GLYCINE
N-METHYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 6 ALA I 534
GLU I 533
ILE I 562
LEU I 525
None
0.99A 1xvaA-4c1nI:
undetectable
1xvaB-4c1nI:
undetectable
1xvaA-4c1nI:
19.69
1xvaB-4c1nI:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YA4_B_CTXB2_2
(CES1 PROTEIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 4 LEU A 292
PRO A  91
ILE A 304
LEU A 303
None
1.12A 1ya4B-4c1nA:
undetectable
1ya4B-4c1nA:
21.32
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.
1YA4_C_CTXC3_2
(CES1 PROTEIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 4 LEU A 292
PRO A  91
ILE A 304
LEU A 303
None
1.07A 1ya4C-4c1nA:
undetectable
1ya4C-4c1nA:
21.32
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.
2AQU_B_DR7B300_2
(HIV-1 PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 11 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.87A 2aquB-4c1nI:
undetectable
2aquB-4c1nI:
12.69
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.
2E1Q_A_SALA2006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 6 THR B 276
VAL B 277
LEU B 213
ALA B 250
None
0.92A 2e1qA-4c1nB:
undetectable
2e1qA-4c1nB:
13.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EJT_A_SAMA501_0
(N(2),N(2)-DIMETHYLGU
ANOSINE TRNA
METHYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU I 510
ILE I 468
ASN I 509
ALA I 402
PHE I 403
None
None
B12  I1631 (-4.2A)
None
None
1.21A 2ejtA-4c1nI:
undetectable
2ejtA-4c1nI:
23.15
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 8 TYR I 547
THR I 216
THR I 217
MET I 415
None
0.97A 2fb2A-4c1nI:
undetectable
2fb2A-4c1nI:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FB2_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 TYR I 547
THR I 216
THR I 217
MET I 415
None
1.03A 2fb2B-4c1nI:
undetectable
2fb2B-4c1nI:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IYF_B_ERYB1399_0
(OLEANDOMYCIN
GLYCOSYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 ASN I 381
ILE I 213
ASN I 238
ALA I 296
ASP I 245
B12  I1631 (-3.9A)
None
None
None
None
1.39A 2iyfB-4c1nI:
undetectable
2iyfB-4c1nI:
22.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NMY_A_ROCA401_1
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.89A 2nmyA-4c1nI:
undetectable
2nmyA-4c1nI:
13.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NNJ_A_225A501_1
(CYTOCHROME P450 2C8)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 10 ILE A 159
VAL A 291
ALA A  95
VAL A  66
ILE A  75
None
0.99A 2nnjA-4c1nA:
undetectable
2nnjA-4c1nA:
24.42
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.
2NNP_A_ROCA401_1
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 11 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.88A 2nnpA-4c1nI:
undetectable
2nnpA-4c1nI:
12.25
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.
2Q83_A_ADNA1_1
(YTAA PROTEIN)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 ILE I 424
PRO I 441
ILE I 500
ILE I 419
None
0.87A 2q83A-4c1nI:
undetectable
2q83A-4c1nI:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QAK_A_1UNA1001_1
(PROTEASE RETROPEPSIN)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.84A 2qakA-4c1nI:
undetectable
2qakA-4c1nI:
14.36
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.
2QD2_A_CHDA426_0
(FERROCHELATASE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 4 LEU A 156
PRO A 157
LEU A 130
ARG A 307
None
1.13A 2qd2A-4c1nA:
3.8
2qd2A-4c1nA:
22.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2R2V_C_ACTC36_0
(GCN4 LEUCINE ZIPPER)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 10 ALA I 515
ALA I 519
GLU I 612
ALA I 616
SER I 615
None
1.35A 2r2vC-4c1nI:
undetectable
2r2vF-4c1nI:
undetectable
2r2vG-4c1nI:
undetectable
2r2vC-4c1nI:
6.55
2r2vF-4c1nI:
6.55
2r2vG-4c1nI:
6.55
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.
2W3B_B_FOLB401_1
(DIHYDROFOLATE
REDUCTASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
3 / 3 GLU B 275
GLN B 248
ARG B  94
None
0.69A 2w3bB-4c1nB:
undetectable
2w3bB-4c1nB:
23.40
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.
2ZJ0_A_2FAA500_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.44A 2zj0A-4c1nB:
undetectable
2zj0A-4c1nB:
22.38
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.
2ZLC_A_VDXA500_1
(VITAMIN D3 RECEPTOR)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 VAL I 538
SER I 568
SER I 573
VAL I 385
LEU I 525
None
1.42A 2zlcA-4c1nI:
undetectable
2zlcA-4c1nI:
19.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AX7_A_SALA1336_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 8 THR B 276
VAL B 277
LEU B 213
ALA B 250
None
0.98A 3ax7A-4c1nB:
undetectable
3ax7A-4c1nB:
13.36
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.
3AX7_B_SALB1336_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 9 THR B 276
VAL B 277
LEU B 213
ALA B 253
ALA B 250
None
1.07A 3ax7B-4c1nB:
0.6
3ax7B-4c1nB:
13.36
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.
3DL9_B_V2HB602_0
(CYTOCHROME P450 2R1)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 VAL B 113
ALA B 116
ALA B 146
GLU B 109
THR B  56
None
1.30A 3dl9B-4c1nB:
undetectable
3dl9B-4c1nB:
23.09
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.
3EKQ_A_ROCA100_1
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.90A 3ekqA-4c1nI:
undetectable
3ekqA-4c1nI:
12.87
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.
3EL1_A_DR7A100_2
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.84A 3el1B-4c1nI:
undetectable
3el1B-4c1nI:
14.86
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.
3EL9_A_DR7A100_2
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 10 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.90A 3el9B-4c1nI:
undetectable
3el9B-4c1nI:
15.11
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.
3ELZ_B_CHDB152_0
(ILEAL BILE
ACID-BINDING PROTEIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
3 / 3 ASN A 400
HIS A 401
VAL A 336
None
0.90A 3elzB-4c1nA:
undetectable
3elzB-4c1nA:
15.76
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.
3ELZ_C_CHDC150_0
(ILEAL BILE
ACID-BINDING PROTEIN)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLN I 240
THR I 302
VAL I 220
LEU I 275
ILE I 211
None
1.35A 3elzC-4c1nI:
undetectable
3elzC-4c1nI:
15.09
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.
3FPJ_B_SAMB301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 7 GLN A 166
GLY A 135
GLU A 106
ALA A 146
None
0.75A 3fpjB-4c1nA:
2.0
3fpjB-4c1nA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G8I_A_RO7A1_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR ALPHA)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 LEU I 269
VAL I 295
LEU I 306
LEU I 195
None
0.81A 3g8iA-4c1nI:
undetectable
3g8iA-4c1nI:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3GLQ_B_RABB602_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.42A 3glqB-4c1nB:
undetectable
3glqB-4c1nB:
22.22
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.
3GWV_A_RFXA801_1
(TRANSPORTER)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU I 231
GLY I 232
LEU I 222
ALA I 210
LEU I 583
None
0.86A 3gwvA-4c1nI:
undetectable
3gwvA-4c1nI:
23.89
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.
3GWX_A_EPAA1_2
(PROTEIN (PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
(PPAR-DELTA)))
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 THR B 233
LEU B 238
ILE B 224
ILE B 223
LEU B  34
None
1.30A 3gwxA-4c1nB:
undetectable
3gwxA-4c1nB:
22.80
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.
3HGX_A_SALA102_1
(SALICYLATE
BIOSYNTHESIS PROTEIN
PCHB)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 ARG B 228
MET B  43
ILE B 283
GLN B 284
None
1.01A 3hgxA-4c1nB:
undetectable
3hgxA-4c1nB:
15.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HS4_A_AZMA702_1
(CARBONIC ANHYDRASE 2)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 7 VAL A 201
TYR A 225
LYS A 198
GLU A 194
None
1.29A 3hs4A-4c1nA:
undetectable
3hs4A-4c1nA:
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.
3KKZ_A_SAMA301_0
(UNCHARACTERIZED
PROTEIN Q5LES9)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT
IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans
;
Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 400
LEU A 373
GLU I 404
ALA I 402
ASN I 509
B12  I1631 ( 3.8A)
B12  I1631 (-4.1A)
None
None
B12  I1631 (-4.2A)
1.14A 3kkzA-4c1nI:
undetectable
3kkzA-4c1nI:
20.55
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.
3KKZ_B_SAMB302_0
(UNCHARACTERIZED
PROTEIN Q5LES9)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 446
GLY I 407
GLY I 411
GLU I 404
ALA I 402
None
1.05A 3kkzB-4c1nI:
undetectable
3kkzB-4c1nI:
20.55
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.
3KM6_A_EAAA222_1
(GLUTATHIONE
S-TRANSFERASE P)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 10 VAL A  61
GLY A  76
GLN A 246
ILE A 229
GLY A 260
None
1.11A 3km6A-4c1nA:
undetectable
3km6A-4c1nA:
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.
3N23_A_OBNA1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 11 GLN A 244
PRO A 232
ASP A 231
ALA A 132
ILE A 161
None
1.35A 3n23A-4c1nA:
undetectable
3n23A-4c1nA:
19.88
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.
3N3I_A_ROCA201_1
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 ASP I 482
ALA I 505
GLY I 407
VAL I 501
ILE I 408
None
1.17A 3n3iA-4c1nI:
undetectable
3n3iA-4c1nI:
17.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OGP_A_017A200_1
(FIV PROTEASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 9 GLY B  87
ALA B  88
ASP B  89
ILE B  90
LEU B  51
None
0.69A 3ogpA-4c1nB:
undetectable
3ogpA-4c1nB:
17.53
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.
3OGP_B_017B200_2
(FIV PROTEASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 9 GLY B  87
ALA B  88
ASP B  89
ILE B  90
LEU B  51
None
0.64A 3ogpB-4c1nB:
undetectable
3ogpB-4c1nB:
17.53
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.
3OXC_A_ROCA401_3
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.85A 3oxcB-4c1nI:
undetectable
3oxcB-4c1nI:
12.25
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.
3OXW_B_017B200_1
(HIV-1 PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
6 / 10 GLY I 297
ALA I 296
ASP I 212
VAL I 294
GLY I 360
VAL I 361
None
1.32A 3oxwA-4c1nI:
undetectable
3oxwA-4c1nI:
13.85
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.
3OZW_A_KKKA413_1
(FLAVOHEMOGLOBIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 8 ILE A   8
GLN A  31
LEU A   3
LEU A  52
None
0.74A 3ozwA-4c1nA:
undetectable
3ozwA-4c1nA:
22.13
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.
3SFU_A_RBVA601_1
(RNA POLYMERASE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 9 ASP A 366
THR A 340
ASN A 341
GLY A 369
ASP A 368
None
1.16A 3sfuA-4c1nA:
undetectable
3sfuA-4c1nA:
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.
3TBG_A_RTZA1_1
(CYTOCHROME P450 2D6)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU I 575
LEU I 582
GLY I 232
LEU I 231
GLN I 221
None
1.26A 3tbgA-4c1nI:
undetectable
3tbgA-4c1nI:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TBG_C_RTZC1_1
(CYTOCHROME P450 2D6)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU I 575
LEU I 582
GLY I 232
LEU I 231
GLN I 221
None
1.29A 3tbgC-4c1nI:
undetectable
3tbgC-4c1nI:
22.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UNI_A_SALA1344_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 THR B 276
VAL B 277
LEU B 213
ALA B 250
None
0.98A 3uniA-4c1nB:
undetectable
3uniA-4c1nB:
13.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W68_C_VIVC301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 ILE B 210
PHE B 245
ILE B 205
VAL B 176
LEU B 153
None
1.14A 3w68C-4c1nB:
undetectable
3w68C-4c1nB:
23.18
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.
4A97_D_ZPCD1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 8 VAL I 538
MET I 384
ILE I 376
GLU I 533
None
1.06A 4a97C-4c1nI:
undetectable
4a97C-4c1nI:
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.
4CUT_A_TYLA2971_1
(BROMODOMAIN ADJACENT
TO ZINC FINGER
DOMAIN PROTEIN 2B)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 4 VAL I 343
VAL I 295
ASN I 273
ILE I 276
None
1.11A 4cutA-4c1nI:
undetectable
4cutA-4c1nI:
13.36
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.
4DX5_B_MIYB1103_1
(ACRIFLAVINE
RESISTANCE PROTEIN B)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 466
SER I 465
ASP I 469
ILE I 468
PHE I 486
None
0.84A 4dx5B-4c1nI:
undetectable
4dx5B-4c1nI:
20.86
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.
4KTT_A_SAMA405_1
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 8 ALA B 299
GLU B 300
ILE B 272
ILE B  64
None
0.86A 4kttB-4c1nB:
undetectable
4kttB-4c1nB:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LVC_A_ADNA501_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.40A 4lvcA-4c1nB:
undetectable
4lvcA-4c1nB:
22.61
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.
4LVC_B_ADNB501_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE
(SAHASE))
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.44A 4lvcB-4c1nB:
undetectable
4lvcB-4c1nB:
22.61
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.
4MA8_C_Z80C301_1
(MAJOR PRION PROTEIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 LEU A  39
GLY A  38
ILE A   8
LYS A   2
None
1.21A 4ma8C-4c1nA:
undetectable
4ma8C-4c1nA:
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.
4O4D_A_ACTA406_0
(INOSITOL
HEXAKISPHOSPHATE
KINASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 THR I 373
ARG I 537
PHE I 567
SER I 568
None
1.22A 4o4dA-4c1nI:
undetectable
4o4dA-4c1nI:
16.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OBW_B_SAMB601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 379
GLY I 382
ILE I 540
MET I 384
GLY I 545
None
1.07A 4obwB-4c1nI:
undetectable
4obwB-4c1nI:
18.09
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.
4PCL_B_SAMB301_0
(O-METHYLTRANSFERASE
FAMILY PROTEIN)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLU I 404
GLY I 405
CYH I 445
ALA I 402
ASN I 509
None
None
None
None
B12  I1631 (-4.2A)
1.43A 4pclB-4c1nI:
undetectable
4pclB-4c1nI:
18.11
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.
4QGI_A_ROCA101_1
(PROTEASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 11 GLY I 577
ALA I 578
ILE I 345
GLY I 355
ILE I 357
None
0.91A 4qgiA-4c1nI:
undetectable
4qgiA-4c1nI:
13.13
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.
4U8V_B_MIYB1103_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 466
SER I 465
ASP I 469
ILE I 468
PHE I 486
None
0.89A 4u8vB-4c1nI:
undetectable
4u8vB-4c1nI:
20.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U8Y_B_MIYB1102_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 466
SER I 465
ASP I 469
ILE I 468
PHE I 486
None
0.83A 4u8yB-4c1nI:
undetectable
4u8yB-4c1nI:
20.86
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.
4U95_B_MIYB1102_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY I 466
SER I 465
ASP I 469
ILE I 468
PHE I 486
None
0.84A 4u95B-4c1nI:
undetectable
4u95B-4c1nI:
20.77
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.
4URO_C_NOVC2000_1
(DNA GYRASE SUBUNIT B)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLU B  52
ARG B 293
ILE B 246
ALA B 212
ILE B 210
None
0.92A 4uroC-4c1nB:
undetectable
4uroC-4c1nB:
21.56
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.
4ZDY_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT
IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLY A 428
ILE I 251
GLY A 379
THR A 382
LEU A 413
B12  I1631 ( 4.0A)
None
None
None
None
1.18A 4zdyA-4c1nA:
undetectable
4zdyA-4c1nA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5EEV_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 10 GLY I 355
ALA I 322
THR I 299
THR I 302
ILE I 308
None
1.17A 5eevA-4c1nI:
undetectable
5eevB-4c1nI:
undetectable
5eevA-4c1nI:
10.47
5eevB-4c1nI:
10.47
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.
5EEX_A_TRPA101_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 10 GLY I 355
ALA I 322
THR I 299
THR I 302
ILE I 308
None
1.17A 5eexA-4c1nI:
undetectable
5eexB-4c1nI:
undetectable
5eexA-4c1nI:
10.47
5eexB-4c1nI:
10.47
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.
5HM8_A_ADNA501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8A-4c1nB:
undetectable
5hm8A-4c1nB:
20.44
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.
5HM8_A_ADNA501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8A-4c1nA:
undetectable
5hm8A-4c1nA:
24.73
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.
5HM8_B_ADNB501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8B-4c1nB:
undetectable
5hm8B-4c1nB:
20.44
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.
5HM8_B_ADNB501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8B-4c1nA:
undetectable
5hm8B-4c1nA:
24.73
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.
5HM8_C_ADNC501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8C-4c1nB:
undetectable
5hm8C-4c1nB:
20.44
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.
5HM8_C_ADNC501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8C-4c1nA:
undetectable
5hm8C-4c1nA:
24.73
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.
5HM8_D_ADND501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8D-4c1nB:
undetectable
5hm8D-4c1nB:
20.44
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.
5HM8_D_ADND501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8D-4c1nA:
undetectable
5hm8D-4c1nA:
24.73
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.
5HM8_E_ADNE501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8E-4c1nB:
undetectable
5hm8E-4c1nB:
20.44
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.
5HM8_E_ADNE501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8E-4c1nA:
undetectable
5hm8E-4c1nA:
24.73
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.
5HM8_F_ADNF501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8F-4c1nB:
undetectable
5hm8F-4c1nB:
20.44
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.
5HM8_F_ADNF501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8F-4c1nA:
undetectable
5hm8F-4c1nA:
24.73
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.
5HM8_G_ADNG501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8G-4c1nB:
undetectable
5hm8G-4c1nB:
20.44
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.
5HM8_G_ADNG501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.15A 5hm8G-4c1nA:
undetectable
5hm8G-4c1nA:
24.73
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.
5HM8_H_ADNH501_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.43A 5hm8H-4c1nB:
undetectable
5hm8H-4c1nB:
20.44
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.
5HM8_H_ADNH501_2
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 5 GLU A 165
GLU A 172
THR A 173
LEU A 160
None
1.11A 5hm8H-4c1nA:
2.6
5hm8H-4c1nA:
24.73
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.
5HRQ_G_IPHG101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
4 / 6 LEU A  53
CYH A  42
HIS A  11
LEU A  12
None
SF4  A1444 (-2.3A)
None
SF4  A1444 ( 4.5A)
1.38A 5hrqD-4c1nA:
undetectable
5hrqG-4c1nA:
undetectable
5hrqH-4c1nA:
undetectable
5hrqD-4c1nA:
7.37
5hrqG-4c1nA:
3.76
5hrqH-4c1nA:
7.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JLC_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 5 GLY I 354
THR I 299
GLY I 228
LEU I 575
None
0.84A 5jlcA-4c1nI:
undetectable
5jlcA-4c1nI:
21.80
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.
5KQY_B_017B101_2
(PROTEASE E35D-DRV)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 GLY I 577
ALA I 578
GLY I 355
ILE I 357
None
0.67A 5kqyB-4c1nI:
undetectable
5kqyB-4c1nI:
12.25
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.
5KR1_B_017B101_2
(PROTEASE PR5-DRV)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 8 GLY I 577
ALA I 578
GLY I 355
ILE I 357
None
0.67A 5kr1B-4c1nI:
undetectable
5kr1B-4c1nI:
13.13
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.
5M66_B_ADNB502_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.44A 5m66B-4c1nB:
undetectable
5m66B-4c1nB:
22.61
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.
5N5D_B_SAMB303_1
(METHYLTRANSFERASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 7 GLY I 460
GLU I 426
ASP I 469
ASN I 473
None
0.99A 5n5dB-4c1nI:
undetectable
5n5dB-4c1nI:
18.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SYE_B_TA1B502_1
(TUBULIN BETA CHAIN)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 GLU I 289
LEU I 122
ASP I 224
ALA I 292
GLY I 184
None
1.23A 5syeB-4c1nI:
undetectable
5syeB-4c1nI:
22.08
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.
5SYJ_B_NIZB810_1
(CATALASE-PEROXIDASE)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
4 / 6 ARG I 585
LEU I 189
PRO I 327
SER I 186
None
1.38A 5syjB-4c1nI:
undetectable
5syjB-4c1nI:
22.00
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.
5UTU_H_ADNH503_1
(ADENOSYLHOMOCYSTEINA
SE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.45A 5utuH-4c1nB:
undetectable
5utuH-4c1nB:
20.44
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.
5V96_B_ADNB502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.44A 5v96B-4c1nB:
undetectable
5v96B-4c1nB:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V96_C_ADNC502_1
(S-ADENOSYL-L-HOMOCYS
TEINE HYDROLASE)
4c1n CO
DEHYDROGENASE/ACETYL
-COA SYNTHASE,
IRON-SULFUR PROTEIN

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU B 305
ASP B  31
GLY B 287
HIS B 288
PHE B  36
None
1.45A 5v96C-4c1nB:
undetectable
5v96C-4c1nB:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VC0_A_RITA602_1
(CYTOCHROME P450 3A4)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 LEU A 156
ILE A  96
ALA A 132
ILE A 264
ALA A 265
None
1.21A 5vc0A-4c1nA:
undetectable
5vc0A-4c1nA:
23.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VCG_A_08YA602_1
(CYTOCHROME P450 3A4)
4c1n CARBON MONOXIDE
DEHYDROGENASE
CORRINOID/IRON-SULFU
R PROTEIN, GAMMA
SUBUNIT

(Carboxydothermus
hydrogenoformans)
5 / 12 SER A 137
THR A 185
ALA A 146
ALA A 169
GLU A 165
None
1.29A 5vcgA-4c1nA:
undetectable
5vcgA-4c1nA:
24.39
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.
6BP4_A_SAMA505_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-9 SPECIFIC)
4c1n IRON-SULFUR CLUSTER
BINDING PROTEIN

(Carboxydothermus
hydrogenoformans)
3 / 3 ILE I 313
ASN I 381
CYH I 395
None
B12  I1631 (-3.9A)
None
0.80A 6bp4A-4c1nI:
undetectable
6bp4A-4c1nI:
20.94