SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5u25'

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.
1CRB_A_RTLA200_0
(CELLULAR RETINOL
BINDING PROTEIN)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 PHE A 523
LEU A 582
ALA A 581
ILE A 544
ILE A 560
 None
 1.13A 1crbA-5u25A:
undetectable		 1crbA-5u25A:
11.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG2_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLY A 128
GLY A 434
ILE A 265
GLY A 125
ALA A 132
 FAD  A 601 (-3.7A)
FAD  A 601 (-3.2A)
None
None
None
 1.19A 1jg2A-5u25A:
2.8		 1jg2A-5u25A:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG2_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLY A 129
GLY A 124
ILE A 265
LEU A 123
GLY A 450
 None
FAD  A 601 (-3.3A)
None
FAD  A 601 (-4.9A)
None
 0.85A 1jg2A-5u25A:
2.8		 1jg2A-5u25A:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG3_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 GLY A 129
GLY A 124
ILE A 265
LEU A 123
GLY A 450
 None
FAD  A 601 (-3.3A)
None
FAD  A 601 (-4.9A)
None
 0.85A 1jg3A-5u25A:
undetectable		 1jg3A-5u25A:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JG3_B_ADNB550_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 GLY A 129
GLY A 124
ILE A 265
LEU A 123
GLY A 450
 None
FAD  A 601 (-3.3A)
None
FAD  A 601 (-4.9A)
None
 0.83A 1jg3B-5u25A:
undetectable		 1jg3B-5u25A:
16.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KGL_A_RTLA175_0
(CELLULAR
RETINOL-BINDING
PROTEIN TYPE I)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 PHE A 523
LEU A 582
ALA A 581
GLY A 561
ILE A 560
 None
 0.95A 1kglA-5u25A:
undetectable		 1kglA-5u25A:
11.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N2X_B_SAMB402_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 THR A 151
GLY A 125
GLY A 126
VAL A 223
GLY A 210
 None
None
FAD  A 601 (-3.4A)
None
None
 0.85A 1n2xB-5u25A:
undetectable		 1n2xB-5u25A:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P91_A_SAMA1401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 GLY A 129
GLY A 124
ILE A 265
TYR A 431
HIS A 429
 None
FAD  A 601 (-3.3A)
None
None
None
 1.15A 1p91A-5u25A:
undetectable		 1p91A-5u25A:
17.91
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.
1SQ5_D_PAUD6004_0
(PANTOTHENATE KINASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 VAL A 121
GLY A 228
LEU A 123
TYR A 118
ILE A 224
 None
FAD  A 601 (-3.8A)
FAD  A 601 (-4.9A)
None
None
 1.24A 1sq5D-5u25A:
undetectable		 1sq5D-5u25A:
18.49
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.
1X70_A_715A801_1
(DIPEPTIDYL PEPTIDASE
IV)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.29A 1x70A-5u25A:
undetectable		 1x70A-5u25A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1X70_B_715B801_1
(DIPEPTIDYL PEPTIDASE
IV)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.30A 1x70B-5u25A:
undetectable		 1x70B-5u25A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HS1_A_017A201_1
(HIV-1 PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 ALA A 550
ILE A 574
GLY A 533
ILE A 522
ILE A 560
 None
 0.87A 2hs1A-5u25A:
undetectable		 2hs1A-5u25A:
10.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2KOT_B_ANWB99_0
(PROTEIN S100-A13)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		4 / 8 VAL A 372
THR A 373
PHE A 374
ASP A 323
 None
 1.09A 2kotB-5u25A:
undetectable		 2kotB-5u25A:
10.32
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.
2NXE_B_SAMB303_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLY A 124
GLY A 129
LEU A 152
ILE A 265
LEU A 236
 FAD  A 601 (-3.3A)
None
None
None
None
 0.87A 2nxeB-5u25A:
undetectable		 2nxeB-5u25A:
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.
2RGU_A_356A901_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.32A 2rguA-5u25A:
undetectable		 2rguA-5u25A:
20.92
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.
2RGU_B_356B902_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.27A 2rguB-5u25A:
undetectable		 2rguB-5u25A:
20.92
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.
2RKG_B_AB1B501_2
(PROTEASE RETROPEPSIN)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 ALA A 550
ILE A 574
GLY A 533
ILE A 522
ILE A 560
 None
 0.93A 2rkgB-5u25A:
undetectable		 2rkgB-5u25A:
12.03
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.
2Y69_T_CHDT1085_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 6A2
CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.47A 2y69A-5u25A:
0.8
2y69B-5u25A:
undetectable
2y69T-5u25A:
undetectable		 2y69A-5u25A:
20.66
2y69B-5u25A:
15.97
2y69T-5u25A:
9.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZBP_A_SAMA300_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLY A 124
GLY A 129
LEU A 152
ILE A 265
LEU A 236
 FAD  A 601 (-3.3A)
None
None
None
None
 0.88A 2zbpA-5u25A:
undetectable		 2zbpA-5u25A:
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.
2ZXW_B_CHDB1086_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 6A2
CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.48A 2zxwA-5u25A:
undetectable
2zxwB-5u25A:
undetectable
2zxwT-5u25A:
undetectable		 2zxwA-5u25A:
20.66
2zxwB-5u25A:
15.97
2zxwT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_B_CHDB1086_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.50A 3abmA-5u25A:
undetectable
3abmB-5u25A:
undetectable
3abmT-5u25A:
undetectable		 3abmA-5u25A:
20.66
3abmB-5u25A:
15.97
3abmT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG1_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.46A 3ag1A-5u25A:
undetectable
3ag1B-5u25A:
undetectable
3ag1T-5u25A:
undetectable		 3ag1A-5u25A:
20.66
3ag1B-5u25A:
15.97
3ag1T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.50A 3ag3A-5u25A:
undetectable
3ag3B-5u25A:
undetectable
3ag3T-5u25A:
undetectable		 3ag3A-5u25A:
20.66
3ag3B-5u25A:
15.97
3ag3T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG4_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.46A 3ag4A-5u25A:
2.1
3ag4B-5u25A:
undetectable
3ag4T-5u25A:
undetectable		 3ag4A-5u25A:
20.66
3ag4B-5u25A:
15.97
3ag4T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJM_A_BJMA1_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.31A 3bjmA-5u25A:
undetectable		 3bjmA-5u25A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJM_B_BJMB2_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.29A 3bjmB-5u25A:
undetectable		 3bjmB-5u25A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DTU_C_DXCC576_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		4 / 8 ALA A 578
ALA A 581
HIS A 567
GLU A 572
 None
 0.81A 3dtuC-5u25A:
undetectable
3dtuD-5u25A:
undetectable		 3dtuC-5u25A:
21.55
3dtuD-5u25A:
17.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKP_C_478C200_1
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 ALA A 550
GLY A 533
ILE A 522
ALA A 578
ILE A 560
 None
 0.88A 3ekpC-5u25A:
undetectable		 3ekpC-5u25A:
11.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKT_B_017B200_2
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 ALA A 550
GLY A 533
ILE A 522
ALA A 578
ILE A 560
 None
 0.84A 3ektB-5u25A:
undetectable		 3ektB-5u25A:
11.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKW_B_DR7B100_1
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 ALA A 550
GLY A 533
ILE A 522
ALA A 578
ILE A 560
 None
 0.94A 3ekwA-5u25A:
undetectable		 3ekwA-5u25A:
11.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EKY_A_DR7A100_2
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 ILE A 522
GLY A 534
ILE A 535
VAL A 468
ILE A 551
 None
 1.26A 3ekyB-5u25A:
undetectable		 3ekyB-5u25A:
11.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G0B_A_T22A800_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.29A 3g0bA-5u25A:
undetectable		 3g0bA-5u25A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G0B_B_T22B800_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.27A 3g0bB-5u25A:
undetectable		 3g0bB-5u25A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G0B_C_T22C800_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.30A 3g0bC-5u25A:
undetectable		 3g0bC-5u25A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3G0B_D_T22D800_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.28A 3g0bD-5u25A:
undetectable		 3g0bD-5u25A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IA4_D_MTXD164_2
(DIHYDROFOLATE
REDUCTASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		3 / 3 ARG A 321
ILE A 301
THR A 358
 None
 0.73A 3ia4D-5u25A:
undetectable		 3ia4D-5u25A:
13.95
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.
3IJX_B_HCZB800_1
(GLUTAMATE RECEPTOR 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 SER A 164
LEU A 299
ILE A 301
SER A 286
GLY A 308
 FAD  A 601 ( 3.9A)
None
None
FAD  A 601 ( 3.8A)
None
 1.34A 3ijxB-5u25A:
undetectable
3ijxD-5u25A:
undetectable		 3ijxB-5u25A:
18.96
3ijxD-5u25A:
18.96
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.
3IK6_B_HCZB262_1
(GLUTAMATE RECEPTOR 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 ILE A 301
SER A 286
GLY A 308
SER A 164
LEU A 299
 None
FAD  A 601 ( 3.8A)
None
FAD  A 601 ( 3.9A)
None
 1.32A 3ik6B-5u25A:
undetectable
3ik6E-5u25A:
undetectable		 3ik6B-5u25A:
18.96
3ik6E-5u25A:
18.96
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.
3ILU_B_HFZB800_1
(GLUTAMATE RECEPTOR 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 SER A 164
LEU A 299
ILE A 301
SER A 286
GLY A 308
 FAD  A 601 ( 3.9A)
None
None
FAD  A 601 ( 3.8A)
None
 1.36A 3iluB-5u25A:
undetectable
3iluE-5u25A:
undetectable		 3iluB-5u25A:
18.96
3iluE-5u25A:
18.96
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.
3ILU_E_HFZE800_1
(GLUTAMATE RECEPTOR 2)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 ILE A 301
SER A 286
GLY A 308
SER A 164
LEU A 299
 None
FAD  A 601 ( 3.8A)
None
FAD  A 601 ( 3.9A)
None
 1.32A 3iluB-5u25A:
undetectable
3iluE-5u25A:
undetectable		 3iluB-5u25A:
18.96
3iluE-5u25A:
18.96
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.
3JB2_A_SAMA1102_0
(STRUCTURAL PROTEIN
VP3)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 ILE A 544
GLY A 541
GLY A 540
ALA A 473
VAL A 472
 None
 0.97A 3jb2A-5u25A:
3.4		 3jb2A-5u25A:
19.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S45_B_478B201_1
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 ALA A 550
ILE A 574
GLY A 533
ILE A 522
ILE A 560
 None
 0.90A 3s45A-5u25A:
undetectable		 3s45A-5u25A:
10.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S45_B_478B201_2
(PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 ALA A 550
ILE A 574
GLY A 533
ILE A 522
ILE A 560
 None
 0.78A 3s45B-5u25A:
undetectable		 3s45B-5u25A:
10.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TEG_A_DAHA416_1
(PHENYLALANYL-TRNA
SYNTHETASE,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 ARG A 337
GLY A 305
GLY A 394
ALA A 393
GLY A 304
 None
 1.08A 3tegA-5u25A:
undetectable		 3tegA-5u25A:
20.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W2T_A_LF7A801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.27A 3w2tA-5u25A:
undetectable		 3w2tA-5u25A:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W2T_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.29A 3w2tB-5u25A:
undetectable		 3w2tB-5u25A:
20.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3X2Q_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.46A 3x2qA-5u25A:
0.7
3x2qB-5u25A:
undetectable
3x2qT-5u25A:
undetectable		 3x2qA-5u25A:
20.66
3x2qB-5u25A:
15.97
3x2qT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3X2Q_O_CHDO302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 GLY A 534
MET A 543
GLY A 541
GLU A 478
THR A 475
 None
 1.48A 3x2qG-5u25A:
undetectable
3x2qN-5u25A:
undetectable
3x2qO-5u25A:
undetectable		 3x2qG-5u25A:
9.34
3x2qN-5u25A:
20.66
3x2qO-5u25A:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 GLY A 434
GLY A 268
ILE A 265
ASP A 435
PRO A 127
 FAD  A 601 (-3.2A)
FAD  A 601 (-3.4A)
None
FAD  A 601 (-2.9A)
FAD  A 601 (-3.9A)
 1.15A 4dcmA-5u25A:
4.0		 4dcmA-5u25A:
20.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4EAT_B_BEZB1000_0
(BENZOATE-COENZYME A
LIGASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 ALA A 432
ALA A 267
GLY A 268
GLY A 399
ILE A 402
 None
FAD  A 601 (-3.8A)
FAD  A 601 (-3.4A)
None
FAD  A 601 ( 4.9A)
 1.07A 4eatB-5u25A:
2.3		 4eatB-5u25A:
21.84
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.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
GLY A 129
TYR A 246
TYR A 149
VAL A 159
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
None
 1.44A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
GLY A 228
VAL A 159
TYR A 246
VAL A 155
 FAD  A 601 (-2.8A)
FAD  A 601 (-3.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-3.8A)
 1.47A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FFW_B_715B801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.28A 4ffwB-5u25A:
undetectable		 4ffwB-5u25A:
21.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YOA_A_017A100_1
(HIV-1 PROTEASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		4 / 6 ASP A 115
THR A 252
PRO A 251
THR A 241
 None
 1.09A 4yoaA-5u25A:
undetectable		 4yoaA-5u25A:
12.71
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.
4Z2D_F_LFXF102_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		3 / 4 ARG A 148
GLY A 226
GLU A 147
 FAD  A 601 (-3.6A)
None
FAD  A 601 (-2.8A)
 0.59A 4z2dB-5u25A:
undetectable
4z2dC-5u25A:
undetectable		 4z2dB-5u25A:
22.14
4z2dC-5u25A:
19.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5H8T_A_RTLA201_0
(RETINOL-BINDING
PROTEIN 1)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 PHE A 523
LEU A 582
ALA A 581
ILE A 544
ILE A 560
 None
 1.14A 5h8tA-5u25A:
undetectable		 5h8tA-5u25A:
12.46
Potential target for repurposing, i.e. matched protein structure has less than 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_T_CHDT103_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.47A 5iy5A-5u25A:
2.1
5iy5B-5u25A:
undetectable
5iy5T-5u25A:
undetectable		 5iy5A-5u25A:
20.66
5iy5B-5u25A:
15.97
5iy5T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KMF_A_6U9A1301_1
(ION TRANSPORT
PROTEIN)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		4 / 6 THR A 569
GLY A 571
GLU A 572
ILE A 560
 None
 0.84A 5kmfA-5u25A:
2.3
5kmfC-5u25A:
2.4		 5kmfA-5u25A:
18.59
5kmfC-5u25A:
18.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VCV_A_1N1A404_2
(MEMBRANE-ASSOCIATED
TYROSINE- AND
THREONINE-SPECIFIC
CDC2-INHIBITORY
KINASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		4 / 5 VAL A 221
HIS A 451
LEU A 152
ASP A 138
 None
 1.50A 5vcvA-5u25A:
undetectable		 5vcvA-5u25A:
19.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5W97_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.49A 5w97A-5u25A:
0.0
5w97B-5u25A:
undetectable
5w97g-5u25A:
undetectable		 5w97A-5u25A:
20.66
5w97B-5u25A:
15.97
5w97g-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.50A 5wauA-5u25A:
undetectable
5wauB-5u25A:
undetectable
5waug-5u25A:
undetectable		 5wauA-5u25A:
20.66
5wauB-5u25A:
15.97
5waug-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WAU_G_CHDG103_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 GLY A 534
MET A 543
GLY A 541
GLU A 478
THR A 475
 None
 1.49A 5wauG-5u25A:
undetectable
5waua-5u25A:
undetectable
5waub-5u25A:
undetectable		 5wauG-5u25A:
9.34
5waua-5u25A:
20.66
5waub-5u25A:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.48A 5x19A-5u25A:
1.8
5x19B-5u25A:
undetectable
5x19T-5u25A:
undetectable		 5x19A-5u25A:
20.66
5x19B-5u25A:
15.97
5x19T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X1B_B_CHDB302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.46A 5x1bA-5u25A:
0.5
5x1bB-5u25A:
undetectable
5x1bT-5u25A:
undetectable		 5x1bA-5u25A:
20.66
5x1bB-5u25A:
15.97
5x1bT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDQ_B_CHDB304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.49A 5xdqA-5u25A:
1.3
5xdqB-5u25A:
undetectable
5xdqT-5u25A:
undetectable		 5xdqA-5u25A:
20.66
5xdqB-5u25A:
15.97
5xdqT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z85_T_CHDT101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.48A 5z85A-5u25A:
0.0
5z85B-5u25A:
undetectable
5z85T-5u25A:
undetectable		 5z85A-5u25A:
20.66
5z85B-5u25A:
15.97
5z85T-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCP_G_CHDG102_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 GLY A 534
MET A 543
GLY A 541
GLU A 478
THR A 475
 None
 1.49A 5zcpG-5u25A:
undetectable
5zcpN-5u25A:
0.0
5zcpO-5u25A:
undetectable		 5zcpG-5u25A:
9.34
5zcpN-5u25A:
20.66
5zcpO-5u25A:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B1E_B_LF7B801_1
(DIPEPTIDYL PEPTIDASE
4)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 12 GLU A 147
VAL A 159
TYR A 246
TYR A 149
VAL A 155
 FAD  A 601 (-2.8A)
None
FAD  A 601 (-4.9A)
FAD  A 601 (-4.1A)
FAD  A 601 (-3.8A)
 1.28A 6b1eB-5u25A:
undetectable		 6b1eB-5u25A:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 11 ALA A 396
VAL A 411
ALA A 404
ALA A 267
LEU A 401
 None
None
None
FAD  A 601 (-3.8A)
None
 1.32A 6h1lB-5u25A:
undetectable		 6h1lB-5u25A:
20.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_G_CHDG104_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 GLY A 534
MET A 543
GLY A 541
GLU A 478
THR A 475
 None
 1.47A 6nknG-5u25A:
undetectable
6nknN-5u25A:
0.3
6nknO-5u25A:
undetectable		 6nknG-5u25A:
9.34
6nknN-5u25A:
20.66
6nknO-5u25A:
15.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NMP_B_CHDB303_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 9 MET A 543
GLY A 541
GLU A 478
THR A 475
GLY A 534
 None
 1.48A 6nmpA-5u25A:
0.0
6nmpB-5u25A:
0.0
6nmpT-5u25A:
0.0		 6nmpA-5u25A:
20.66
6nmpB-5u25A:
15.97
6nmpT-5u25A:
9.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NMP_O_CHDO302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2,
MITOCHONDRIAL)		 5u25 DIHYDROLIPOAMIDE
DEHYDROGENASE (E3
COMPONENT OF
PYRUVATE AND
2-OXOGLUTARATE
DEHYDROGENASE
COMPLEXES)
(Neisseria
gonorrhoeae) 		5 / 10 GLY A 534
MET A 543
GLY A 541
GLU A 478
THR A 475
 None
 1.45A 6nmpG-5u25A:
undetectable
6nmpN-5u25A:
0.0
6nmpO-5u25A:
undetectable		 6nmpG-5u25A:
9.34
6nmpN-5u25A:
20.66
6nmpO-5u25A:
15.97