SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4eq5'

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.
1A27_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		5 / 12 VAL A 267
GLY A 310
LEU A 348
ASN A 349
VAL A 327
 None
 1.37A 1a27A-4eq5A:
undetectable		 1a27A-4eq5A:
21.33
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.
1DMA_B_NCAB700_0
(EXOTOXIN A)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 6 GLY A 464
TYR A 466
ALA A 551
GLU A 549
 None
 0.97A 1dmaB-4eq5A:
undetectable		 1dmaB-4eq5A:
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.
1FML_B_RTLB501_0
(RETINOL DEHYDRATASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		5 / 12 ILE A 278
LEU A 301
LEU A 348
ILE A 383
PHE A 351
 None
None
None
None
AMP  A 601 (-3.3A)
 0.83A 1fmlB-4eq5A:
undetectable		 1fmlB-4eq5A:
20.49
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.
1HXB_A_ROCA100_2
(HIV-1 PROTEASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		3 / 3 ARG A 454
THR A 492
VAL A 457
 None
 0.89A 1hxbA-4eq5A:
undetectable		 1hxbA-4eq5A:
11.55
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.
1XVA_A_ACTA294_0
(GLYCINE
N-METHYLTRANSFERASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 5 ILE A 433
LEU A 249
ALA A 397
GLU A 398
 None
 1.12A 1xvaA-4eq5A:
undetectable
1xvaB-4eq5A:
undetectable		 1xvaA-4eq5A:
20.14
1xvaB-4eq5A:
20.14
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.
1YA4_C_CTXC3_2
(CES1 PROTEIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 4 LEU A 442
PRO A 526
ILE A 522
LEU A 534
 None
 1.01A 1ya4C-4eq5A:
undetectable		 1ya4C-4eq5A:
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.
1ZZR_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.90A 1zzrA-4eq5A:
undetectable
1zzrB-4eq5A:
undetectable		 1zzrA-4eq5A:
20.91
1zzrB-4eq5A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZR_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.91A 1zzrA-4eq5A:
undetectable
1zzrB-4eq5A:
undetectable		 1zzrA-4eq5A:
20.91
1zzrB-4eq5A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZU_A_H4BA760_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.88A 1zzuA-4eq5A:
undetectable
1zzuB-4eq5A:
undetectable		 1zzuA-4eq5A:
20.91
1zzuB-4eq5A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZU_B_H4BB761_1
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.88A 1zzuA-4eq5A:
undetectable
1zzuB-4eq5A:
undetectable		 1zzuA-4eq5A:
20.91
1zzuB-4eq5A:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 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_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 LEU A 534
GLN A 523
PHE A 532
LEU A 440
 None
 0.82A 2dyrP-4eq5A:
undetectable
2dyrW-4eq5A:
undetectable		 2dyrP-4eq5A:
16.64
2dyrW-4eq5A:
9.26
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.
2PKK_A_2FAA501_2
(ADENOSINE KINASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 4 ALA A 212
VAL A 198
PHE A 208
THR A 205
 None
 1.16A 2pkkA-4eq5A:
undetectable		 2pkkA-4eq5A:
21.11
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.
2QAK_A_1UNA1001_2
(PROTEASE RETROPEPSIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		3 / 3 ARG A 454
THR A 492
VAL A 457
 None
 0.79A 2qakA-4eq5A:
undetectable		 2qakA-4eq5A:
12.42
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.
2ZXW_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 LEU A 534
GLN A 523
PHE A 532
LEU A 440
 None
 0.81A 2zxwC-4eq5A:
undetectable
2zxwJ-4eq5A:
undetectable		 2zxwC-4eq5A:
16.64
2zxwJ-4eq5A:
9.26
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.
2ZXW_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 6 LEU A 534
GLN A 523
PHE A 532
LEU A 440
 None
 0.77A 2zxwP-4eq5A:
undetectable
2zxwW-4eq5A:
undetectable		 2zxwP-4eq5A:
16.64
2zxwW-4eq5A:
9.26
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.
3AG1_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 6 LEU A 534
GLN A 523
PHE A 532
LEU A 440
 None
 0.86A 3ag1C-4eq5A:
undetectable
3ag1J-4eq5A:
undetectable		 3ag1C-4eq5A:
16.64
3ag1J-4eq5A:
9.26
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.
3DQR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.95A 3dqrA-4eq5A:
undetectable
3dqrB-4eq5A:
undetectable		 3dqrA-4eq5A:
20.71
3dqrB-4eq5A:
20.71
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.
3DQR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.93A 3dqrA-4eq5A:
undetectable
3dqrB-4eq5A:
undetectable		 3dqrA-4eq5A:
20.71
3dqrB-4eq5A:
20.71
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.
3GN8_A_DEXA247_2
(GLUCOCORTICOID
RECEPTOR 2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		3 / 3 MET A 413
MET A 367
PHE A 351
 AMP  A 601 ( 3.8A)
None
AMP  A 601 (-3.3A)
 1.35A 3gn8A-4eq5A:
undetectable		 3gn8A-4eq5A:
17.77
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.
3JX2_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.85A 3jx2A-4eq5A:
undetectable
3jx2B-4eq5A:
undetectable		 3jx2A-4eq5A:
20.71
3jx2B-4eq5A:
20.71
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.
3JX2_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.88A 3jx2A-4eq5A:
undetectable
3jx2B-4eq5A:
undetectable		 3jx2A-4eq5A:
20.71
3jx2B-4eq5A:
20.71
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.
3JX3_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.90A 3jx3A-4eq5A:
undetectable
3jx3B-4eq5A:
undetectable		 3jx3A-4eq5A:
20.71
3jx3B-4eq5A:
20.71
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.
3JX3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.87A 3jx3A-4eq5A:
undetectable
3jx3B-4eq5A:
undetectable		 3jx3A-4eq5A:
20.71
3jx3B-4eq5A:
20.71
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.
3JX4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.90A 3jx4A-4eq5A:
undetectable
3jx4B-4eq5A:
undetectable		 3jx4A-4eq5A:
20.71
3jx4B-4eq5A:
20.71
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.
3JX5_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.86A 3jx5A-4eq5A:
undetectable
3jx5B-4eq5A:
undetectable		 3jx5A-4eq5A:
20.71
3jx5B-4eq5A:
20.71
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.
3JX5_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.88A 3jx5A-4eq5A:
undetectable
3jx5B-4eq5A:
undetectable		 3jx5A-4eq5A:
20.71
3jx5B-4eq5A:
20.71
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.
3JX6_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.81A 3jx6A-4eq5A:
undetectable
3jx6B-4eq5A:
undetectable		 3jx6A-4eq5A:
20.54
3jx6B-4eq5A:
20.54
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.
3JX6_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.85A 3jx6A-4eq5A:
undetectable
3jx6B-4eq5A:
undetectable		 3jx6A-4eq5A:
20.54
3jx6B-4eq5A:
20.54
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.
3KO0_K_TFPK202_1
(PROTEIN S100-A4)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		5 / 12 LEU A  41
SER A  38
PHE A  40
ILE A  57
LEU A 183
 None
 1.16A 3ko0K-4eq5A:
undetectable
3ko0L-4eq5A:
undetectable
3ko0S-4eq5A:
undetectable
3ko0T-4eq5A:
undetectable		 3ko0K-4eq5A:
11.80
3ko0L-4eq5A:
11.80
3ko0S-4eq5A:
11.80
3ko0T-4eq5A:
11.80
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.
3NLJ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.85A 3nljA-4eq5A:
undetectable
3nljB-4eq5A:
undetectable		 3nljA-4eq5A:
20.54
3nljB-4eq5A:
20.54
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.
3NLJ_B_H4BB761_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.86A 3nljA-4eq5A:
undetectable
3nljB-4eq5A:
undetectable		 3nljA-4eq5A:
20.54
3nljB-4eq5A:
20.54
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.
3NLP_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.87A 3nlpA-4eq5A:
undetectable
3nlpB-4eq5A:
undetectable		 3nlpA-4eq5A:
20.71
3nlpB-4eq5A:
20.71
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.
3NLP_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.90A 3nlpA-4eq5A:
undetectable
3nlpB-4eq5A:
undetectable		 3nlpA-4eq5A:
20.71
3nlpB-4eq5A:
20.71
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.
3NLQ_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.87A 3nlqA-4eq5A:
undetectable
3nlqB-4eq5A:
undetectable		 3nlqA-4eq5A:
20.71
3nlqB-4eq5A:
20.71
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.
3NLQ_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.92A 3nlqA-4eq5A:
undetectable
3nlqB-4eq5A:
undetectable		 3nlqA-4eq5A:
20.71
3nlqB-4eq5A:
20.71
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.
3NLR_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.86A 3nlrA-4eq5A:
undetectable
3nlrB-4eq5A:
undetectable		 3nlrA-4eq5A:
20.71
3nlrB-4eq5A:
20.71
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.
3NLR_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.90A 3nlrA-4eq5A:
undetectable
3nlrB-4eq5A:
undetectable		 3nlrA-4eq5A:
20.71
3nlrB-4eq5A:
20.71
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.
3QWU_A_ADNA501_1
(DNA LIGASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		7 / 12 GLU A 259
LYS A 261
ARG A 281
GLU A 311
PHE A 351
LYS A 415
LYS A 432
 AMP  A 601 (-4.1A)
AMP  A 601 (-3.8A)
AMP  A 601 (-3.3A)
AMP  A 601 (-3.5A)
AMP  A 601 (-3.3A)
AMP  A 601 (-2.8A)
AMP  A 601 (-3.5A)
 0.86A 3qwuA-4eq5A:
10.9		 3qwuA-4eq5A:
23.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QWU_B_ADNB501_1
(DNA LIGASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		6 / 11 GLU A 259
LYS A 261
ARG A 281
GLU A 311
PHE A 351
LYS A 415
 AMP  A 601 (-4.1A)
AMP  A 601 (-3.8A)
AMP  A 601 (-3.3A)
AMP  A 601 (-3.5A)
AMP  A 601 (-3.3A)
AMP  A 601 (-2.8A)
 0.83A 3qwuB-4eq5A:
6.3		 3qwuB-4eq5A:
23.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX3_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.91A 4cx3A-4eq5A:
undetectable
4cx3B-4eq5A:
undetectable		 4cx3A-4eq5A:
20.71
4cx3B-4eq5A:
20.71
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.
4CX3_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.90A 4cx3A-4eq5A:
undetectable
4cx3B-4eq5A:
undetectable		 4cx3A-4eq5A:
20.71
4cx3B-4eq5A:
20.71
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.
4CX4_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.91A 4cx4A-4eq5A:
undetectable
4cx4B-4eq5A:
undetectable		 4cx4A-4eq5A:
20.71
4cx4B-4eq5A:
20.71
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.
4CX4_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.90A 4cx4A-4eq5A:
undetectable
4cx4B-4eq5A:
undetectable		 4cx4A-4eq5A:
20.71
4cx4B-4eq5A:
20.71
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.
4HYF_A_NCAA1201_0
(TANKYRASE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLY A 464
TYR A 466
ALA A 551
GLU A 549
 None
 0.87A 4hyfA-4eq5A:
undetectable		 4hyfA-4eq5A:
18.80
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.
4HYF_C_NCAC1201_0
(TANKYRASE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 GLY A 464
TYR A 466
ALA A 551
GLU A 549
 None
 0.89A 4hyfC-4eq5A:
undetectable		 4hyfC-4eq5A:
18.80
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.
4LV9_A_20JA601_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 ARG A 266
ASP A 352
SER A 419
TYR A 421
 AMP  A 601 (-4.4A)
None
None
None
 0.94A 4lv9A-4eq5A:
undetectable
4lv9B-4eq5A:
undetectable		 4lv9A-4eq5A:
24.33
4lv9B-4eq5A:
24.33
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.
4W5N_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 6 LEU A  56
ILE A  57
LEU A  17
TYR A  14
 None
 0.84A 4w5nA-4eq5A:
undetectable		 4w5nA-4eq5A:
20.71
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.
4XV2_A_P06A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 4 GLY A 181
LEU A  41
PHE A  40
ILE A  57
 None
 0.93A 4xv2A-4eq5A:
undetectable		 4xv2A-4eq5A:
19.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Z4F_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 LEU A 405
PRO A 435
GLU A 398
TYR A 401
 None
 0.89A 4z4fA-4eq5A:
undetectable		 4z4fA-4eq5A:
20.71
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.
4Z4G_A_IPHA903_0
(PROTEIN ARGONAUTE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 6 LEU A 405
PRO A 435
GLU A 398
TYR A 401
 None
 0.97A 4z4gA-4eq5A:
undetectable		 4z4gA-4eq5A:
20.71
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.
5ADD_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.87A 5addA-4eq5A:
undetectable
5addB-4eq5A:
undetectable		 5addA-4eq5A:
20.71
5addB-4eq5A:
20.71
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.
5ADE_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.86A 5adeA-4eq5A:
undetectable
5adeB-4eq5A:
undetectable		 5adeA-4eq5A:
20.71
5adeB-4eq5A:
20.71
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.
5G0P_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 VAL A 214
ARG A 200
VAL A 193
GLU A 218
 None
 0.86A 5g0pA-4eq5A:
undetectable
5g0pB-4eq5A:
undetectable		 5g0pA-4eq5A:
20.71
5g0pB-4eq5A:
20.71
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.
5G0P_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 GLU A 218
VAL A 214
ARG A 200
VAL A 193
 None
 0.89A 5g0pA-4eq5A:
undetectable
5g0pB-4eq5A:
undetectable		 5g0pA-4eq5A:
20.71
5g0pB-4eq5A:
20.71
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.
5GQB_A_GCSA603_1
(CHITINASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 PHE A 351
GLY A 310
ASP A 545
ARG A 543
 AMP  A 601 (-3.3A)
None
None
None
 0.99A 5gqbA-4eq5A:
undetectable		 5gqbA-4eq5A:
22.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		5 / 12 GLY A  59
ALA A 186
SER A  12
ILE A 125
TYR A  14
 None
 1.23A 5igvA-4eq5A:
undetectable		 5igvA-4eq5A:
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.
5T7B_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 7 LEU A 405
PRO A 435
GLU A 398
TYR A 401
 None
 0.96A 5t7bA-4eq5A:
undetectable		 5t7bA-4eq5A:
20.64
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.
5UUN_B_ACTB310_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 4 GLY A 547
PRO A 548
VAL A 514
ARG A 282
 None
 1.26A 5uunA-4eq5A:
undetectable
5uunB-4eq5A:
undetectable		 5uunA-4eq5A:
20.32
5uunB-4eq5A:
20.32
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.
5X66_F_MTXF402_1
(THYMIDYLATE SYNTHASE)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		5 / 12 ILE A 383
LEU A 312
THR A 287
ALA A 314
VAL A 315
 None
 1.06A 5x66F-4eq5A:
undetectable		 5x66F-4eq5A:
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.
6MDQ_A_TESA604_0
(SERUM ALBUMIN)		 4eq5 DNA LIGASE
(Thermococcus
sibiricus) 		4 / 8 ALA A 215
GLY A 222
LEU A 223
ALA A 201
 None
 0.74A 6mdqA-4eq5A:
undetectable		 6mdqA-4eq5A:
10.34