SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1nj8'

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.
1EPB_B_9CRB165_1
(EPIDIDYMAL RETINOIC
ACID-BINDING PROTEIN)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 PHE A 177
ILE A  43
VAL A 256
ILE A 257
ILE A 261
None
1.02A 1epbB-1nj8A:
undetectable
1epbB-1nj8A:
15.84
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.
1IGX_A_EPAA700_2
(PROSTAGLANDIN
ENDOPEROXIDE H
SYNTHASE-1)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 8 VAL A 220
TYR A 250
ILE A 106
LEU A 223
None
0.91A 1igxA-1nj8A:
undetectable
1igxA-1nj8A:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UPF_A_URFA999_1
(URACIL
PHOSPHORIBOSYLTRANSF
ERASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 5 ALA A  56
TYR A 125
ILE A 124
ASP A  49
None
1.13A 1upfA-1nj8A:
undetectable
1upfA-1nj8A:
19.96
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.
1UPF_C_URFC999_1
(URACIL
PHOSPHORIBOSYLTRANSF
ERASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 5 ALA A  56
TYR A 125
ILE A 124
ASP A  49
None
1.12A 1upfC-1nj8A:
undetectable
1upfC-1nj8A:
19.96
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.
1V54_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 1v54A-1nj8A:
0.0
1v54C-1nj8A:
undetectable
1v54A-1nj8A:
20.61
1v54C-1nj8A:
17.96
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.
1V54_P_CHDP4525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 1v54N-1nj8A:
0.0
1v54P-1nj8A:
undetectable
1v54N-1nj8A:
20.61
1v54P-1nj8A:
17.96
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.
1V55_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 1v55A-1nj8A:
undetectable
1v55C-1nj8A:
undetectable
1v55A-1nj8A:
20.61
1v55C-1nj8A:
17.96
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.
1Z11_A_8MOA501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 11 PHE A 178
PHE A 177
GLY A 251
ILE A 127
PHE A  41
None
1.04A 1z11A-1nj8A:
undetectable
1z11A-1nj8A:
22.76
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.
1Z11_B_8MOB501_0
(CYTOCHROME P450,
FAMILY 2, SUBFAMILY
A, POLYPEPTIDE 6)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 11 PHE A 178
PHE A 177
GLY A 251
ILE A 127
PHE A  41
None
1.04A 1z11B-1nj8A:
undetectable
1z11B-1nj8A:
22.76
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.
2DYR_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.32A 2dyrA-1nj8A:
0.0
2dyrC-1nj8A:
undetectable
2dyrA-1nj8A:
20.61
2dyrC-1nj8A:
17.96
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.
2DYR_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.32A 2dyrN-1nj8A:
undetectable
2dyrP-1nj8A:
undetectable
2dyrN-1nj8A:
20.61
2dyrP-1nj8A:
17.96
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.
2DYS_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.30A 2dysA-1nj8A:
undetectable
2dysC-1nj8A:
undetectable
2dysA-1nj8A:
20.61
2dysC-1nj8A:
17.96
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.
2DYS_P_CHDP304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.27A 2dysN-1nj8A:
undetectable
2dysP-1nj8A:
undetectable
2dysN-1nj8A:
20.61
2dysP-1nj8A:
17.96
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.
2EIJ_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.29A 2eijA-1nj8A:
0.0
2eijC-1nj8A:
undetectable
2eijA-1nj8A:
20.61
2eijC-1nj8A:
17.96
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.
2EIJ_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.29A 2eijN-1nj8A:
undetectable
2eijP-1nj8A:
undetectable
2eijN-1nj8A:
20.61
2eijP-1nj8A:
17.96
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.
2EIK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 2eikA-1nj8A:
0.9
2eikC-1nj8A:
undetectable
2eikA-1nj8A:
20.61
2eikC-1nj8A:
17.96
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.
2EIK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 2eikN-1nj8A:
undetectable
2eikP-1nj8A:
undetectable
2eikN-1nj8A:
20.61
2eikP-1nj8A:
17.96
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.
2EIL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.32A 2eilA-1nj8A:
undetectable
2eilC-1nj8A:
undetectable
2eilA-1nj8A:
20.61
2eilC-1nj8A:
17.96
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.
2EIL_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.30A 2eilN-1nj8A:
undetectable
2eilP-1nj8A:
undetectable
2eilN-1nj8A:
20.61
2eilP-1nj8A:
17.96
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.
2EIM_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.29A 2eimA-1nj8A:
undetectable
2eimC-1nj8A:
undetectable
2eimA-1nj8A:
20.61
2eimC-1nj8A:
17.96
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.
2EIM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.30A 2eimN-1nj8A:
0.0
2eimP-1nj8A:
undetectable
2eimN-1nj8A:
20.61
2eimP-1nj8A:
17.96
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.
2EIN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.29A 2einA-1nj8A:
undetectable
2einC-1nj8A:
undetectable
2einA-1nj8A:
20.61
2einC-1nj8A:
17.96
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.
2EIN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 2einN-1nj8A:
undetectable
2einP-1nj8A:
undetectable
2einN-1nj8A:
20.61
2einP-1nj8A:
17.96
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.
2VMY_A_FFOA505_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 GLU A 338
LYS A 324
PHE A 325
PRO A 321
None
1.40A 2vmyA-1nj8A:
undetectable
2vmyA-1nj8A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y69_A_CHDA1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 2y69A-1nj8A:
undetectable
2y69C-1nj8A:
undetectable
2y69A-1nj8A:
20.61
2y69C-1nj8A:
17.96
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.
2ZXW_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.33A 2zxwA-1nj8A:
undetectable
2zxwC-1nj8A:
undetectable
2zxwA-1nj8A:
20.61
2zxwC-1nj8A:
17.96
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.
2ZXW_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.30A 2zxwN-1nj8A:
undetectable
2zxwP-1nj8A:
undetectable
2zxwN-1nj8A:
20.61
2zxwP-1nj8A:
17.96
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.
3ABK_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 3abkA-1nj8A:
undetectable
3abkC-1nj8A:
undetectable
3abkA-1nj8A:
20.61
3abkC-1nj8A:
17.96
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.
3ABK_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 3abkN-1nj8A:
undetectable
3abkP-1nj8A:
undetectable
3abkN-1nj8A:
20.61
3abkP-1nj8A:
17.96
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.
3ABM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.32A 3abmN-1nj8A:
0.0
3abmP-1nj8A:
undetectable
3abmN-1nj8A:
20.61
3abmP-1nj8A:
17.96
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.
3AG1_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.37A 3ag1A-1nj8A:
undetectable
3ag1C-1nj8A:
undetectable
3ag1A-1nj8A:
20.61
3ag1C-1nj8A:
17.96
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.
3AG1_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.37A 3ag1N-1nj8A:
0.0
3ag1P-1nj8A:
undetectable
3ag1N-1nj8A:
20.61
3ag1P-1nj8A:
17.96
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.
3AG2_A_CHDA525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.33A 3ag2A-1nj8A:
0.0
3ag2C-1nj8A:
undetectable
3ag2A-1nj8A:
20.61
3ag2C-1nj8A:
17.96
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.
3AG2_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.32A 3ag2N-1nj8A:
undetectable
3ag2P-1nj8A:
undetectable
3ag2N-1nj8A:
20.61
3ag2P-1nj8A:
17.96
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.
3AG3_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 3ag3A-1nj8A:
undetectable
3ag3C-1nj8A:
undetectable
3ag3A-1nj8A:
20.61
3ag3C-1nj8A:
17.96
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.
3AG3_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.31A 3ag3N-1nj8A:
undetectable
3ag3P-1nj8A:
undetectable
3ag3N-1nj8A:
20.61
3ag3P-1nj8A:
17.96
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.
3AG4_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.33A 3ag4A-1nj8A:
undetectable
3ag4C-1nj8A:
undetectable
3ag4A-1nj8A:
20.61
3ag4C-1nj8A:
17.96
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.
3AG4_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 3ag4N-1nj8A:
undetectable
3ag4P-1nj8A:
undetectable
3ag4N-1nj8A:
20.61
3ag4P-1nj8A:
17.96
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.
3ASN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 3asnA-1nj8A:
0.0
3asnC-1nj8A:
undetectable
3asnA-1nj8A:
20.61
3asnC-1nj8A:
17.96
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.
3ETE_B_H3PB552_1
(GLUTAMATE
DEHYDROGENASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 TYR A 125
TYR A 174
ILE A 252
None
0.59A 3eteA-1nj8A:
undetectable
3eteB-1nj8A:
undetectable
3eteA-1nj8A:
22.92
3eteB-1nj8A:
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.
3NDU_D_ROCD100_3
(PROTEASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 ARG A 255
VAL A 128
THR A 130
None
0.87A 3nduD-1nj8A:
undetectable
3nduD-1nj8A:
12.09
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.
3NDW_A_RITA100_2
(PROTEASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 9 ARG A 317
ALA A 299
ILE A 349
GLY A 340
ILE A 283
None
1.04A 3ndwB-1nj8A:
undetectable
3ndwB-1nj8A:
14.14
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.
3U9F_E_CLME221_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 PHE A 196
CYH A 249
HIS A 221
None
1.26A 3u9fF-1nj8A:
undetectable
3u9fF-1nj8A:
17.92
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.
4COX_C_IMNC701_1
(CYCLOOXYGENASE-2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
1.12A 4coxC-1nj8A:
undetectable
4coxC-1nj8A:
21.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HVC_A_HFGA1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.22A 4hvcA-1nj8A:
42.6
4hvcA-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HVC_A_HFGA1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.44A 4hvcA-1nj8A:
42.6
4hvcA-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HVC_B_HFGB1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.05A 4hvcB-1nj8A:
42.7
4hvcB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HVC_B_HFGB1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.37A 4hvcB-1nj8A:
42.7
4hvcB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4HVC_B_HFGB1602_0
(BIFUNCTIONAL
GLUTAMATE/PROLINE--T
RNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
HIS A 154
PHE A 196
None
0.91A 4hvcB-1nj8A:
42.7
4hvcB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4K88_A_HFGA602_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 GLU A  80
VAL A  81
PRO A 100
THR A 101
GLU A 103
GLU A 152
HIS A 221
None
0.73A 4k88A-1nj8A:
41.8
4k88A-1nj8A:
36.64
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4K88_A_HFGA602_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 GLU A  80
VAL A  81
PRO A 100
THR A 101
GLU A 103
PHE A 196
None
1.12A 4k88A-1nj8A:
41.8
4k88A-1nj8A:
36.64
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.
4MWV_A_BCZA513_1
(NEURAMINIDASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 ARG A 213
GLU A   2
ARG A 139
None
0.82A 4mwvA-1nj8A:
undetectable
4mwvA-1nj8A:
20.58
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OLF_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.28A 4olfA-1nj8A:
42.4
4olfA-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OLF_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.43A 4olfA-1nj8A:
42.4
4olfA-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4OLF_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
HIS A 154
PHE A 196
THR A 219
None
0.96A 4olfA-1nj8A:
42.4
4olfA-1nj8A:
35.17
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.
4OLT_A_GCSA304_1
(CHITOSANASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 TYR A  29
ILE A 257
THR A 149
TYR A   7
None
1.44A 4oltA-1nj8A:
0.0
4oltA-1nj8A:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLT_B_GCSB304_1
(CHITOSANASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 5 TYR A  29
ILE A 257
THR A 149
TYR A   7
None
1.43A 4oltB-1nj8A:
0.0
4oltB-1nj8A:
21.27
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
ARG A 132
PHE A 196
None
1.32A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.10A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
HIS A 154
GLY A 251
None
0.46A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
None
0.95A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 227
None
1.18A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_A_HFGA803_1
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 GLU A 103
THR A 219
HIS A 221
None
0.75A 4q15A-1nj8A:
42.9
4q15A-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.10A 4q15B-1nj8A:
43.2
4q15B-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
GLU A 152
GLY A 251
None
0.42A 4q15B-1nj8A:
43.2
4q15B-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
PHE A 196
None
1.02A 4q15B-1nj8A:
43.2
4q15B-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_B_HFGB803_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
PHE A 227
None
1.17A 4q15B-1nj8A:
43.2
4q15B-1nj8A:
35.17
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4Q15_B_HFGB803_1
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 GLU A 103
THR A 219
HIS A 221
None
0.75A 4q15B-1nj8A:
43.2
4q15B-1nj8A:
35.17
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.
4QOP_A_HQEA503_1
(CATALASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 9 PRO A 121
TYR A 246
LEU A 120
PHE A 235
ASP A 243
None
1.41A 4qopA-1nj8A:
0.0
4qopA-1nj8A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QOP_B_HQEB503_1
(CATALASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 9 PRO A 121
TYR A 246
LEU A 120
PHE A 235
ASP A 243
None
1.41A 4qopB-1nj8A:
0.0
4qopB-1nj8A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QOP_D_HQED503_1
(CATALASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 9 PRO A 121
TYR A 246
LEU A 120
PHE A 235
ASP A 243
None
1.41A 4qopD-1nj8A:
0.0
4qopD-1nj8A:
21.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWP_A_GCSA303_1
(CHITOSANASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 TYR A  29
ILE A 257
THR A 149
TYR A   7
None
1.44A 4qwpA-1nj8A:
0.0
4qwpA-1nj8A:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWP_B_GCSB302_1
(CHITOSANASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 5 TYR A  29
ILE A 257
THR A 149
TYR A   7
None
1.46A 4qwpB-1nj8A:
0.0
4qwpB-1nj8A:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRW_A_LURA705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.98A 4rrwA-1nj8A:
0.0
4rrwA-1nj8A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRW_B_LURB705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.98A 4rrwB-1nj8A:
undetectable
4rrwB-1nj8A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRW_C_LURC705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.97A 4rrwC-1nj8A:
undetectable
4rrwC-1nj8A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_A_LURA705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.98A 4rrzA-1nj8A:
0.0
4rrzA-1nj8A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_B_LURB705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.98A 4rrzB-1nj8A:
undetectable
4rrzB-1nj8A:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RRZ_C_LURC705_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
0.97A 4rrzC-1nj8A:
undetectable
4rrzC-1nj8A:
21.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
GLU A 152
GLY A 251
None
0.72A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.00A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
GLY A 251
None
0.40A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
HIS A 154
PHE A 196
None
0.83A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.22A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_A_HFGA802_1
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 THR A 101
GLU A 103
THR A 219
HIS A 221
None
0.85A 4ydqA-1nj8A:
42.0
4ydqA-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 GLU A  80
VAL A  81
PRO A 100
GLU A 152
GLY A 251
None
0.70A 4ydqB-1nj8A:
42.0
4ydqB-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
HIS A 154
GLY A 251
None
0.46A 4ydqB-1nj8A:
42.0
4ydqB-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
HIS A 154
PHE A 227
None
1.18A 4ydqB-1nj8A:
42.0
4ydqB-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_B_HFGB802_0
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
None
0.93A 4ydqB-1nj8A:
42.0
4ydqB-1nj8A:
35.78
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4YDQ_B_HFGB802_1
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 GLU A 103
THR A 219
HIS A 221
None
0.72A 4ydqB-1nj8A:
42.0
4ydqB-1nj8A:
35.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5B1A_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 5b1aN-1nj8A:
undetectable
5b1aP-1nj8A:
undetectable
5b1aN-1nj8A:
20.61
5b1aP-1nj8A:
17.96
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.
5B1B_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 5b1bN-1nj8A:
undetectable
5b1bP-1nj8A:
undetectable
5b1bN-1nj8A:
20.61
5b1bP-1nj8A:
17.96
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.
5DZK_Y_BEZY801_0
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 1
ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 5 ILE A 261
GLY A 332
ILE A  10
LEU A 272
None
0.92A 5dzkd-1nj8A:
undetectable
5dzkk-1nj8A:
undetectable
5dzky-1nj8A:
undetectable
5dzkd-1nj8A:
21.05
5dzkk-1nj8A:
18.34
5dzky-1nj8A:
3.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_A_HFGA702_0
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.12A 5f9zA-1nj8A:
41.1
5f9zA-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_A_HFGA702_0
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
GLY A 251
None
0.38A 5f9zA-1nj8A:
41.1
5f9zA-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_A_HFGA702_1
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 THR A 101
GLU A 103
THR A 219
HIS A 221
None
0.79A 5f9zA-1nj8A:
41.1
5f9zA-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_B_HFGB703_0
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.14A 5f9zB-1nj8A:
41.6
5f9zB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_B_HFGB703_0
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
GLY A 251
None
0.40A 5f9zB-1nj8A:
41.6
5f9zB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5F9Z_B_HFGB703_1
(AMINOACYL-TRNA
SYNTHETASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 THR A 101
GLU A 103
THR A 219
HIS A 221
None
0.78A 5f9zB-1nj8A:
41.6
5f9zB-1nj8A:
36.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5IFU_A_GBMA801_1
(PROLINE--TRNA LIGASE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 PHE A   3
TYR A   7
ARG A 255
ILE A 257
ILE A 261
TYR A 455
None
0.72A 5ifuA-1nj8A:
37.0
5ifuA-1nj8A:
35.17
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.
5IKR_A_ID8A601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  11
SER A   8
TYR A  29
VAL A  19
GLY A  27
None
1.18A 5ikrA-1nj8A:
0.0
5ikrA-1nj8A:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKT_B_TLFB601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A 433
VAL A 418
LEU A 417
GLY A 439
LEU A 429
None
1.12A 5iktB-1nj8A:
0.0
5iktB-1nj8A:
20.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IY5_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.35A 5iy5A-1nj8A:
undetectable
5iy5C-1nj8A:
undetectable
5iy5A-1nj8A:
20.61
5iy5C-1nj8A:
18.04
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.
5M45_D_ACTD803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 GLU A 398
PRO A 419
ILE A 400
LEU A 397
None
1.27A 5m45D-1nj8A:
0.0
5m45D-1nj8A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M45_J_ACTJ803_0
(ACETONE CARBOXYLASE
ALPHA SUBUNIT)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 4 GLU A 398
PRO A 419
ILE A 400
LEU A 397
None
1.26A 5m45J-1nj8A:
0.0
5m45J-1nj8A:
20.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NUM_A_Z80A201_1
(BETA-LACTOGLOBULIN)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 8 VAL A 371
ILE A 349
LEU A 367
ILE A 302
ILE A 283
None
1.12A 5numA-1nj8A:
undetectable
5numA-1nj8A:
10.89
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.
5X19_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.37A 5x19N-1nj8A:
undetectable
5x19P-1nj8A:
undetectable
5x19N-1nj8A:
20.61
5x19P-1nj8A:
17.96
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIO_A_HFGA801_0
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 GLU A  80
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.48A 5xioA-1nj8A:
40.8
5xioA-1nj8A:
37.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIO_A_HFGA801_0
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 GLU A  80
VAL A  81
PRO A 100
HIS A 154
PHE A 196
None
0.93A 5xioA-1nj8A:
40.8
5xioA-1nj8A:
37.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIO_A_HFGA801_1
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 THR A 101
GLU A 103
HIS A 221
None
0.76A 5xioA-1nj8A:
40.8
5xioA-1nj8A:
37.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIO_B_HFGB802_0
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
8 / 12 GLU A  80
VAL A  81
PRO A 100
THR A 101
GLU A 152
HIS A 154
THR A 219
HIS A 221
None
0.67A 5xioB-1nj8A:
40.8
5xioB-1nj8A:
37.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIO_B_HFGB802_0
(PROLINE-TRNA
SYNTHETASE CLASS II
AARS (YBAK RNA
BINDING DOMAIN PLUS
TRNA SYNTHETASE))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
8 / 12 GLU A  80
VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
THR A 219
HIS A 221
None
1.03A 5xioB-1nj8A:
40.8
5xioB-1nj8A:
37.40
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
GLY A 251
None
0.93A 5xipA-1nj8A:
42.0
5xipA-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
None
1.06A 5xipA-1nj8A:
42.0
5xipA-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
THR A 219
None
0.89A 5xipA-1nj8A:
42.0
5xipA-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
HIS A 154
THR A 219
GLY A 251
None
0.44A 5xipA-1nj8A:
42.0
5xipA-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_A_HFGA1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 227
None
1.16A 5xipA-1nj8A:
42.0
5xipA-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_B_HFGB1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 GLU A  80
PRO A 100
THR A 101
GLU A 103
PHE A 196
THR A 219
HIS A 221
None
1.18A 5xipB-1nj8A:
41.9
5xipB-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_B_HFGB1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 GLU A  80
VAL A  81
PRO A 100
THR A 101
PHE A 196
THR A 219
HIS A 221
None
1.15A 5xipB-1nj8A:
41.9
5xipB-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_B_HFGB1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 PRO A 100
THR A 101
GLU A 103
HIS A 154
PHE A 196
THR A 219
HIS A 221
None
1.06A 5xipB-1nj8A:
41.9
5xipB-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_B_HFGB1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
THR A 219
HIS A 221
None
1.00A 5xipB-1nj8A:
41.9
5xipB-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_B_HFGB1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 227
None
1.15A 5xipB-1nj8A:
41.9
5xipB-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 GLU A  80
VAL A  81
PRO A 100
GLU A 103
PHE A 196
THR A 219
None
1.26A 5xipC-1nj8A:
42.0
5xipC-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
9 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
GLU A 103
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.62A 5xipC-1nj8A:
42.0
5xipC-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
8 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
GLU A 103
HIS A 154
PHE A 196
THR A 219
None
0.96A 5xipC-1nj8A:
42.0
5xipC-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_C_HFGC1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
PHE A 227
None
1.10A 5xipC-1nj8A:
42.0
5xipC-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_D_HFGD1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 GLU A  80
VAL A  81
PRO A 100
GLU A 103
PHE A 196
THR A 219
None
1.26A 5xipD-1nj8A:
42.6
5xipD-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_D_HFGD1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
VAL A  81
PRO A 100
ARG A 132
PHE A 196
None
1.46A 5xipD-1nj8A:
42.6
5xipD-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_D_HFGD1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
GLU A 103
GLU A 152
THR A 219
None
0.70A 5xipD-1nj8A:
42.6
5xipD-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_D_HFGD1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
THR A 101
GLU A 103
PHE A 196
THR A 219
None
1.06A 5xipD-1nj8A:
42.6
5xipD-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIP_D_HFGD1003_0
(PROLYL-TRNA
SYNTHETASE, PUTATIVE)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
PHE A 227
None
1.12A 5xipD-1nj8A:
42.6
5xipD-1nj8A:
35.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_A_HFGA1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
THR A 219
None
1.15A 5xiqA-1nj8A:
42.5
5xiqA-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_A_HFGA1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.47A 5xiqA-1nj8A:
42.5
5xiqA-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_A_HFGA1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
HIS A 154
PHE A 196
THR A 219
None
0.98A 5xiqA-1nj8A:
42.5
5xiqA-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_A_HFGA1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.20A 5xiqA-1nj8A:
42.5
5xiqA-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_B_HFGB1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
THR A 219
None
1.13A 5xiqB-1nj8A:
42.3
5xiqB-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_B_HFGB1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
None
0.51A 5xiqB-1nj8A:
42.3
5xiqB-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_B_HFGB1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
HIS A 154
PHE A 196
THR A 219
None
0.98A 5xiqB-1nj8A:
42.3
5xiqB-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_B_HFGB1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.23A 5xiqB-1nj8A:
42.3
5xiqB-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_B_HFGB1002_1
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 THR A 101
GLU A 103
HIS A 221
None
0.67A 5xiqB-1nj8A:
42.3
5xiqB-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 GLU A  80
VAL A  81
ARG A 132
PHE A 196
THR A 219
None
1.47A 5xiqC-1nj8A:
42.6
5xiqC-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 GLU A  80
VAL A  81
PRO A 100
PHE A 196
THR A 219
None
1.17A 5xiqC-1nj8A:
42.6
5xiqC-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
HIS A 154
PHE A 227
None
1.13A 5xiqC-1nj8A:
42.6
5xiqC-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
THR A 101
GLU A 152
HIS A 154
THR A 219
None
0.59A 5xiqC-1nj8A:
42.6
5xiqC-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_C_HFGC1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 VAL A  81
PRO A 100
THR A 101
HIS A 154
PHE A 196
THR A 219
None
1.02A 5xiqC-1nj8A:
42.6
5xiqC-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_D_HFGD1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
PHE A 196
THR A 219
None
1.12A 5xiqD-1nj8A:
42.3
5xiqD-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_D_HFGD1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.50A 5xiqD-1nj8A:
42.3
5xiqD-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_D_HFGD1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
6 / 12 LEU A  67
VAL A  81
PRO A 100
HIS A 154
PHE A 196
THR A 219
None
0.96A 5xiqD-1nj8A:
42.3
5xiqD-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_D_HFGD1002_0
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 VAL A  81
PRO A 100
GLU A 152
HIS A 154
PHE A 227
None
1.21A 5xiqD-1nj8A:
42.3
5xiqD-1nj8A:
36.90
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5XIQ_D_HFGD1002_1
(PROLYL-TRNA
SYNTHETASE (PRORS))
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
3 / 3 THR A 101
GLU A 103
HIS A 221
None
0.74A 5xiqD-1nj8A:
42.3
5xiqD-1nj8A:
36.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCQ_P_CHDP301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.35A 5zcqN-1nj8A:
0.0
5zcqP-1nj8A:
undetectable
5zcqN-1nj8A:
20.61
5zcqP-1nj8A:
17.96
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.
6HLO_A_GBQA1501_1
(SUBSTANCE-P
RECEPTOR,GLGA
GLYCOGEN
SYNTHASE,SUBSTANCE-P
RECEPTOR)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 9 ILE A 451
TRP A 193
GLU A 427
VAL A 433
ILE A 405
None
1.46A 6hloA-1nj8A:
2.9
6hloA-1nj8A:
20.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6MN8_A_HFGA603_0
(UNCHARACTERIZED
PROTEIN)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
5 / 12 LEU A  67
GLU A  80
VAL A  81
PRO A 100
GLU A 152
None
0.83A 6mn8A-1nj8A:
40.2
6mn8A-1nj8A:
37.18
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6MN8_A_HFGA603_0
(UNCHARACTERIZED
PROTEIN)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
7 / 12 LEU A  67
VAL A  81
PRO A 100
GLU A 152
HIS A 154
THR A 219
GLY A 251
None
0.52A 6mn8A-1nj8A:
40.2
6mn8A-1nj8A:
37.18
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.
6NKN_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.34A 6nknA-1nj8A:
0.0
6nknC-1nj8A:
undetectable
6nknA-1nj8A:
20.61
6nknC-1nj8A:
17.96
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.
6NMP_C_CHDC303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 6 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.39A 6nmpA-1nj8A:
0.0
6nmpC-1nj8A:
0.0
6nmpA-1nj8A:
20.61
6nmpC-1nj8A:
17.96
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.
6NMP_P_CHDP302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)
1nj8 PROLINE-TRNA
SYNTHETASE

(Methanocaldococc
us
jannaschii)
4 / 7 HIS A 264
ASP A 206
THR A 207
TYR A 185
None
1.41A 6nmpN-1nj8A:
undetectable
6nmpP-1nj8A:
undetectable
6nmpN-1nj8A:
20.61
6nmpP-1nj8A:
17.96