SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4ci0'

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.
1CD2_A_FOLA307_1
(DIHYDROFOLATE
REDUCTASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
3 / 3 GLU A 325
ILE A 324
ARG A 219
None
0.66A 1cd2A-4ci0A:
undetectable
1cd2A-4ci0A:
22.56
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.
1W0G_A_MYTA1499_1
(CYTOCHROME P450 3A4)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 6 SER A 129
ILE A 133
ALA A 107
ALA A 114
None
0.79A 1w0gA-4ci0A:
0.1
1w0gA-4ci0A:
21.14
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.
1ZEA_A_DHIA6_0
(MONOCLONAL
ANTI-CHOLERA TOXIN
IGG1 KAPPA ANTIBODY,
H CHAIN
MONOCLONAL
ANTI-CHOLERA TOXIN
IGG1 KAPPA ANTIBODY,
L CHAIN
SHORT SYNTHETIC
D-AMINO ACID PEPTIDE
D2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA
F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis;
Methanothermobac
ter
marburgensis)
3 / 3 TRP B 264
ARG B 261
PHE C 281
None
SF4  C1282 ( 4.4A)
None
1.22A 1zeaH-4ci0B:
undetectable
1zeaL-4ci0B:
undetectable
1zeaH-4ci0B:
20.79
1zeaL-4ci0B:
23.02
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.
2CP4_A_CAMA416_0
(CYTOCHROME P450-CAM)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 10 THR C 207
LEU C  33
VAL C  29
GLY C  31
VAL C 219
FAD  C1283 (-4.6A)
None
FAD  C1283 (-4.0A)
None
None
1.32A 2cp4A-4ci0C:
undetectable
2cp4A-4ci0C:
20.88
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.
2JN3_A_JN3A130_1
(FATTY ACID-BINDING
PROTEIN, LIVER)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU A 188
ILE A 127
HIS A 280
ILE A 193
LEU A 192
None
1.09A 2jn3A-4ci0A:
undetectable
2jn3A-4ci0A:
16.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QHF_A_ACTA502_0
(CHORISMATE SYNTHASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
3 / 3 GLY B  59
ASP B  60
SER B  63
SF4  B1274 (-3.5A)
SF4  B1274 (-1.7A)
None
0.74A 2qhfA-4ci0B:
undetectable
2qhfA-4ci0B:
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.
2VD0_B_D27B1200_0
(GLUTATHIONE-REQUIRIN
G PROSTAGLANDIN D
SYNTHASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 10 GLY C 131
ARG C 222
ALA C 225
THR C 106
LEU C 129
None
1.38A 2vd0B-4ci0C:
undetectable
2vd0B-4ci0C:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W9S_E_TOPE1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 8 ALA B  61
LEU B  87
ILE A 108
THR B  58
None
0.76A 2w9sE-4ci0B:
undetectable
2w9sE-4ci0B:
17.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X7H_A_PFNA1374_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 6 PRO C 139
SER C 142
GLU C 136
CYH C 192
None
None
None
SF4  C1282 (-1.9A)
1.09A 2x7hA-4ci0C:
undetectable
2x7hA-4ci0C:
22.31
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.
2ZGW_B_ADNB1302_1
(BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 6 GLU A 165
ALA A  89
ASN A 162
ALA A 305
None
1.20A 2zgwB-4ci0A:
undetectable
2zgwB-4ci0A:
19.14
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.
2ZJ0_B_2FAB500_2
(ADENOSYLHOMOCYSTEINA
SE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 5 LEU A 381
THR A 351
THR B  86
HIS B  53
None
1.24A 2zj0B-4ci0A:
undetectable
2zj0B-4ci0A:
21.69
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.
3EEY_D_SAMD300_0
(PUTATIVE RRNA
METHYLASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 12 GLY B 207
ILE B 254
GLY B 170
LEU B 235
THR B 232
SF4  B1275 ( 4.0A)
SF4  B1275 ( 4.6A)
None
SF4  B1275 (-3.7A)
SF4  B1275 (-3.4A)
1.18A 3eeyD-4ci0B:
undetectable
3eeyD-4ci0B:
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.
3EEY_J_SAMJ300_0
(PUTATIVE RRNA
METHYLASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 12 GLY B 207
ILE B 254
GLY B 170
LEU B 235
THR B 232
SF4  B1275 ( 4.0A)
SF4  B1275 ( 4.6A)
None
SF4  B1275 (-3.7A)
SF4  B1275 (-3.4A)
1.12A 3eeyJ-4ci0B:
undetectable
3eeyJ-4ci0B:
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.
3FL9_C_TOPC200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 11 ALA C 101
ASN C 137
VAL C  82
ILE B 221
THR C  99
None
SF4  C1282 ( 3.7A)
None
SF4  C1282 ( 3.6A)
None
1.34A 3fl9C-4ci0C:
undetectable
3fl9C-4ci0C:
20.89
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.
3FL9_E_TOPE200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 10 LEU B 100
LEU B  64
ILE B  81
LEU B  75
THR B 181
None
1.10A 3fl9E-4ci0B:
undetectable
3fl9E-4ci0B:
19.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3J6P_B_TA1B502_1
(TUBULIN BETA CHAIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
5 / 12 GLU A 325
LEU A 319
SER A 212
PHE A 222
LEU A 348
None
1.02A 3j6pB-4ci0A:
undetectable
3j6pB-4ci0A:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3K13_C_THHC643_1
(5-METHYLTETRAHYDROFO
LATE-HOMOCYSTEINE
METHYLTRANSFERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis;
Methanothermobac
ter
marburgensis)
3 / 3 ASN B 245
ASP B 236
ARG A  94
None
0.88A 3k13C-4ci0B:
undetectable
3k13C-4ci0B:
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.
3N2O_C_AG2C1002_1
(BIOSYNTHETIC
ARGININE
DECARBOXYLASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 8 SER C  65
ASP C  16
LEU C 238
ASP C  38
None
0.99A 3n2oC-4ci0C:
undetectable
3n2oD-4ci0C:
undetectable
3n2oC-4ci0C:
19.17
3n2oD-4ci0C:
19.17
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.
3OKX_A_SAMA201_0
(YAEB-LIKE PROTEIN
RPA0152)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU C 253
TYR C 133
GLY C 208
THR C 207
SER C 206
None
None
FAD  C1283 (-3.6A)
FAD  C1283 (-4.6A)
None
1.26A 3okxA-4ci0C:
undetectable
3okxA-4ci0C:
20.85
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.
3OKX_A_SAMA201_0
(YAEB-LIKE PROTEIN
RPA0152)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU C 253
TYR C 133
THR C 207
SER C 206
LEU C 257
None
None
FAD  C1283 (-4.6A)
None
None
1.38A 3okxA-4ci0C:
undetectable
3okxA-4ci0C:
20.85
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.
3OKX_B_SAMB201_1
(YAEB-LIKE PROTEIN
RPA0152)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU C 253
TYR C 133
GLY C 208
THR C 207
LEU C 257
None
None
FAD  C1283 (-3.6A)
FAD  C1283 (-4.6A)
None
1.19A 3okxB-4ci0C:
undetectable
3okxB-4ci0C:
20.85
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.
3OKX_B_SAMB201_1
(YAEB-LIKE PROTEIN
RPA0152)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU C 253
TYR C 133
GLY C 208
THR C 207
SER C 206
None
None
FAD  C1283 (-3.6A)
FAD  C1283 (-4.6A)
None
1.26A 3okxB-4ci0C:
undetectable
3okxB-4ci0C:
20.85
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.
3QEL_B_QELB1_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE [NMDA]
RECEPTOR SUBUNIT
EPSILON-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 11 TYR B  68
ALA A 107
ILE A 133
THR B  58
GLU A  14
None
1.28A 3qelA-4ci0B:
undetectable
3qelB-4ci0B:
undetectable
3qelA-4ci0B:
21.59
3qelB-4ci0B:
22.43
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.
3TBG_A_RTZA2_1
(CYTOCHROME P450 2D6)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 11 THR A 351
VAL A 349
LEU A  43
VAL A  40
PHE B 138
None
1.32A 3tbgA-4ci0A:
0.7
3tbgA-4ci0A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TBG_A_RTZA2_1
(CYTOCHROME P450 2D6)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 11 VAL A 349
LEU A  43
VAL A  40
THR A 385
PHE B 138
None
1.38A 3tbgA-4ci0A:
0.7
3tbgA-4ci0A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TBG_C_RTZC2_1
(CYTOCHROME P450 2D6)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 10 THR A 351
VAL A 349
LEU A  43
VAL A  40
PHE B 138
None
1.38A 3tbgC-4ci0A:
undetectable
3tbgC-4ci0A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TBG_C_RTZC2_1
(CYTOCHROME P450 2D6)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 10 VAL A 349
LEU A  43
VAL A  40
THR A 385
PHE B 138
None
1.39A 3tbgC-4ci0A:
undetectable
3tbgC-4ci0A:
24.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UR0_C_SVRC516_1
(RNA-DEPENDENT RNA
POLYMERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
5 / 9 PRO A 327
GLY A 329
ALA A 326
ALA A  73
LEU A  98
None
None
FE  A1387 ( 3.9A)
None
None
1.48A 3ur0C-4ci0A:
undetectable
3ur0C-4ci0A:
21.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4B9Z_A_ACRA1818_1
(ALPHA-GLUCOSIDASE,
PUTATIVE, ADG31B)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU A 224
ILE A 321
LEU A 348
GLU A 229
PHE A 344
None
None
None
FE2  A1389 ( 4.3A)
None
1.46A 4b9zA-4ci0A:
undetectable
4b9zA-4ci0A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EJJ_D_NCTD501_1
(CYTOCHROME P450 2A6)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 7 GLY C 211
THR C 218
ILE C 220
LEU C   3
None
0.84A 4ejjD-4ci0C:
undetectable
4ejjD-4ci0C:
20.97
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.
4IIL_A_RBFA401_2
(MEMBRANE LIPOPROTEIN
TPN38(B))
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 8 VAL A 140
ASN A 136
GLN A 177
ILE A 295
None
0.99A 4iilA-4ci0A:
undetectable
4iilA-4ci0A:
24.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IK7_A_IMNA201_1
(TRANSTHYRETIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 7 LEU C 128
THR C 207
THR C 221
VAL C 219
None
FAD  C1283 (-4.6A)
None
None
0.66A 4ik7A-4ci0C:
undetectable
4ik7A-4ci0C:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IK7_B_IMNB201_1
(TRANSTHYRETIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 8 LEU C 128
THR C 207
THR C 221
VAL C 219
None
FAD  C1283 (-4.6A)
None
None
0.57A 4ik7B-4ci0C:
undetectable
4ik7B-4ci0C:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MK4_A_CHDA504_0
(FERROCHELATASE,
MITOCHONDRIAL)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis;
Methanothermobac
ter
marburgensis)
4 / 8 SER A 152
ARG A 155
VAL C 119
GLY C 118
None
0.97A 4mk4A-4ci0A:
undetectable
4mk4A-4ci0A:
20.63
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.
4RJD_B_TFPB204_1
(CALMODULIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 8 LEU A 330
GLY A 329
GLU A 286
ALA A 282
None
0.62A 4rjdA-4ci0A:
undetectable
4rjdB-4ci0A:
undetectable
4rjdA-4ci0A:
13.79
4rjdB-4ci0A:
13.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RP8_C_ASCC501_0
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 12 LEU B 199
ILE B 254
GLN B 258
ALA B 134
ILE B 177
None
SF4  B1275 ( 4.6A)
None
None
None
1.21A 4rp8C-4ci0B:
undetectable
4rp8C-4ci0B:
18.67
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.
4W5O_A_IPHA907_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 5 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.36A 4w5oA-4ci0B:
2.1
4w5oA-4ci0B:
16.84
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.
4W5Q_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.35A 4w5qA-4ci0B:
undetectable
4w5qA-4ci0B:
16.84
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.
4W5R_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.34A 4w5rA-4ci0B:
undetectable
4w5rA-4ci0B:
16.84
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.
4W5T_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.34A 4w5tA-4ci0B:
2.5
4w5tA-4ci0B:
16.84
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.
4XE3_B_CL6B502_1
(CYTOCHROME P-450)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
4 / 5 LEU C 128
ALA C 203
VAL C 219
ILE C 220
None
0.97A 4xe3B-4ci0C:
undetectable
4xe3B-4ci0C:
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.
4Z4C_A_IPHA906_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.36A 4z4cA-4ci0B:
undetectable
4z4cA-4ci0B:
16.84
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.
4Z4D_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 5 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.36A 4z4dA-4ci0B:
undetectable
4z4dA-4ci0B:
16.84
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.
4Z4E_A_IPHA907_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 5 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.36A 4z4eA-4ci0B:
1.9
4z4eA-4ci0B:
16.84
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.
4Z4F_A_IPHA904_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.36A 4z4fA-4ci0B:
2.4
4z4fA-4ci0B:
16.84
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.
4Z4G_A_IPHA905_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 5 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.35A 4z4gA-4ci0B:
2.5
4z4gA-4ci0B:
16.84
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.
4Z4I_A_IPHA904_0
(PROTEIN ARGONAUTE-2)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
4 / 6 ALA B 167
THR B 135
THR B 203
TYR B 202
None
1.34A 4z4iA-4ci0B:
2.5
4z4iA-4ci0B:
16.84
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.
4ZO1_X_T3X500_1
(THYROID HORMONE
RECEPTOR BETA)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
5 / 12 ILE A 133
ALA A 137
ALA A 290
LEU A 291
HIS A 110
None
1.49A 4zo1X-4ci0A:
undetectable
4zo1X-4ci0A:
22.19
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.
5B8I_C_FK5C201_2
(CALCINEURIN SUBUNIT
B, VARIANT
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 4 LEU A 291
MET A 287
VAL A 103
ASN A 104
None
1.27A 5b8iB-4ci0A:
0.2
5b8iB-4ci0A:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CP4_A_CAMA422_0
(CYTOCHROME P450CAM)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 9 THR C 207
LEU C  33
VAL C  29
GLY C  31
VAL C 219
FAD  C1283 (-4.6A)
None
FAD  C1283 (-4.0A)
None
None
1.31A 5cp4A-4ci0C:
undetectable
5cp4A-4ci0C:
20.88
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.
5EWJ_D_QELD503_1
(NMDA GLUTAMATE
RECEPTOR SUBUNIT
GLUTAMATE RECEPTOR
IONOTROPIC, NMDA 2B)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 12 TYR B  68
ALA A 107
ILE A 133
THR B  58
GLU A  14
None
1.30A 5ewjC-4ci0B:
2.3
5ewjD-4ci0B:
2.5
5ewjC-4ci0B:
21.57
5ewjD-4ci0B:
22.43
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.
5HWA_A_GCSA303_1
(CHITOSANASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 5 HIS A 150
VAL A 141
GLY A 146
ALA A 145
SF4  B1274 ( 4.4A)
None
None
None
0.95A 5hwaA-4ci0A:
1.7
5hwaA-4ci0A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEP_A_VDYA201_2
(CDL2.3B)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
5 / 9 ILE B 178
PRO B 175
VAL B 257
ILE B 254
LEU B 100
None
None
None
SF4  B1275 ( 4.6A)
None
1.46A 5iepA-4ci0B:
undetectable
5iepA-4ci0B:
19.93
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.
5J2T_C_VLBC503_2
(TUBULIN ALPHA-1B
CHAIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 VAL C  29
ALA C  34
VAL C 130
GLY C 131
ILE C 132
FAD  C1283 (-4.0A)
None
None
None
FAD  C1283 (-3.6A)
0.79A 5j2tC-4ci0C:
undetectable
5j2tC-4ci0C:
20.58
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.
5JHD_E_EDTE301_0
(BETA-2-MICROGLOBULIN
TCRBETA CHAIN)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 8 TYR A  34
SER A  36
THR A 385
PRO A   9
None
1.11A 5jhdE-4ci0A:
undetectable
5jhdG-4ci0A:
undetectable
5jhdE-4ci0A:
20.05
5jhdG-4ci0A:
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.
5JMN_C_FUAC1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
3 / 3 VAL A 154
HIS A  70
VAL A  59
None
FE  A1387 ( 4.6A)
None
0.68A 5jmnC-4ci0A:
undetectable
5jmnC-4ci0A:
18.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NFP_A_8W5A804_2
(GLUCOCORTICOID
RECEPTOR)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 4 LEU A  96
MET A 159
ILE A 215
LEU A  72
None
1.29A 5nfpA-4ci0A:
undetectable
5nfpA-4ci0A:
19.34
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.
5NNA_A_BZMA301_0
(ISATIN HYDROLASE A)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 ILE C 220
LEU C   3
SER C 212
GLY C 208
GLY C 211
None
None
None
FAD  C1283 (-3.6A)
None
1.12A 5nnaA-4ci0C:
undetectable
5nnaA-4ci0C:
21.04
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.
5NNA_B_BZMB301_0
(ISATIN HYDROLASE A)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 ILE C 220
LEU C   3
SER C 212
GLY C 208
GLY C 211
None
None
None
FAD  C1283 (-3.6A)
None
1.13A 5nnaB-4ci0C:
undetectable
5nnaB-4ci0C:
21.04
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.
5NNA_C_BZMC301_0
(ISATIN HYDROLASE A)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 ILE C 220
LEU C   3
SER C 212
GLY C 208
GLY C 211
None
None
None
FAD  C1283 (-3.6A)
None
1.12A 5nnaC-4ci0C:
undetectable
5nnaC-4ci0C:
21.04
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.
5NNA_D_BZMD301_0
(ISATIN HYDROLASE A)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 ILE C 220
LEU C   3
SER C 212
GLY C 208
GLY C 211
None
None
None
FAD  C1283 (-3.6A)
None
1.11A 5nnaD-4ci0C:
undetectable
5nnaD-4ci0C:
21.04
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.
5VOO_F_C2FF3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 GLY C 226
LEU C  68
GLY C  98
ARG C 110
ILE C  42
None
1.11A 5vooF-4ci0C:
undetectable
5vooF-4ci0C:
25.61
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.
5VOP_B_C2FB3001_0
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis)
5 / 12 GLY C 226
LEU C  68
GLY C  98
ARG C 110
ILE C  42
None
1.15A 5vopB-4ci0C:
undetectable
5vopB-4ci0C:
25.61
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.
6A5Y_D_9CRD501_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
3 / 3 ASN A 104
VAL A 186
HIS A 185
None
0.79A 6a5yD-4ci0A:
undetectable
6a5yD-4ci0A:
13.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EF6_A_ACTA405_0
(AMINOGLYCOSIDE
PHOSPHOTRANSFERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA
F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA
F420-REDUCING
HYDROGENASE, SUBUNIT
BETA

(Methanothermobac
ter
marburgensis;
Methanothermobac
ter
marburgensis;
Methanothermobac
ter
marburgensis)
4 / 6 ARG A 134
PRO B 175
ARG C 120
ILE A 149
None
1.34A 6ef6A-4ci0A:
undetectable
6ef6A-4ci0A:
22.92
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.
6EQP_A_BUWA601_1
(CHOLINESTERASE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
ALPHA

(Methanothermobac
ter
marburgensis)
4 / 8 GLY A 275
GLN A 279
PHE A 365
TYR A 369
None
1.01A 6eqpA-4ci0A:
undetectable
6eqpA-4ci0A:
12.34
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.
6EXI_D_ADND502_1
(ADENOSYLHOMOCYSTEINA
SE)
4ci0 F420-REDUCING
HYDROGENASE, SUBUNIT
GAMMA

(Methanothermobac
ter
marburgensis)
3 / 3 LEU B 100
ASN B  67
LEU B  75
None
0.67A 6exiD-4ci0B:
undetectable
6exiD-4ci0B:
14.96