SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1a80'

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.
1DVT_A_FLPA125_1
(TRANSTHYRETIN)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 ALA A 129
LEU A 132
LEU A  76
THR A  74
 None
 0.80A 1dvtA-1a80A:
0.0
1dvtB-1a80A:
0.0		 1dvtA-1a80A:
19.55
1dvtB-1a80A:
19.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1M8E_B_H4BB903_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.03A 1m8eB-1a80A:
0.0		 1m8eB-1a80A:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.01A 1nodB-1a80A:
undetectable		 1nodB-1a80A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QOM_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 0.99A 1qomA-1a80A:
undetectable		 1qomA-1a80A:
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.
2HC4_A_VDXA525_1
(VITAMIN D RECEPTOR)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 PHE A  71
LEU A 104
SER A 135
HIS A 141
LEU A 146
 None
 1.26A 2hc4A-1a80A:
0.0		 2hc4A-1a80A:
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.
2IGT_A_SAMA1001_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ASP A 252
ASP A 259
ASP A 249
 None
 0.73A 2igtA-1a80A:
undetectable		 2igtA-1a80A:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IGT_B_SAMB1002_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ASP A 252
ASP A 259
ASP A 249
 None
 0.74A 2igtB-1a80A:
undetectable		 2igtB-1a80A:
21.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2J2P_B_SC2B1290_1
(FICOLIN-2)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 SER A  63
LEU A  37
LEU A  70
ARG A  42
 None
 0.81A 2j2pA-1a80A:
0.0
2j2pB-1a80A:
0.0		 2j2pA-1a80A:
20.45
2j2pB-1a80A:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.01A 2nodB-1a80A:
0.0		 2nodB-1a80A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Q6F_C_010C6_0
(INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE
N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ASN A 140
LEU A 142
HIS A 273
 NDP  A 300 ( 3.3A)
None
None
 0.80A 2q6fB-1a80A:
undetectable		 2q6fB-1a80A:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DFR_A_MTXA164_1
(DIHYDROFOLATE
REDUCTASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 LEU A  99
ASP A 103
HIS A  43
LEU A  37
ALA A  66
 None
 1.08A 3dfrA-1a80A:
undetectable		 3dfrA-1a80A:
19.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DTU_C_DXCC576_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 PRO A 202
ALA A 206
ALA A 209
THR A 253
 None
 0.80A 3dtuC-1a80A:
0.0
3dtuD-1a80A:
0.0		 3dtuC-1a80A:
18.55
3dtuD-1a80A:
21.97
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.
3E68_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.04A 3e68A-1a80A:
0.0		 3e68A-1a80A:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E6T_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.02A 3e6tB-1a80A:
0.0		 3e6tB-1a80A:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.02A 3e7iB-1a80A:
0.0		 3e7iB-1a80A:
20.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FI0_E_TRPE1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 7 GLY A  18
ILE A  14
VAL A 228
GLN A 161
 None
None
None
NDP  A 300 (-3.3A)
 0.87A 3fi0E-1a80A:
undetectable		 3fi0E-1a80A:
26.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MTE_B_SAMB220_0
(16S RRNA METHYLASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 ALA A 209
ALA A 206
LEU A 223
THR A 251
LEU A 250
 None
 1.04A 3mteB-1a80A:
undetectable		 3mteB-1a80A:
20.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.07A 3nw2A-1a80A:
0.0		 3nw2A-1a80A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 ARG A 171
ILE A 255
TRP A 221
 None
 1.03A 3nw2B-1a80A:
undetectable		 3nw2B-1a80A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OXW_D_017D200_1
(HIV-1 PROTEASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 10 LEU A 219
GLY A  18
GLY A  40
VAL A  39
VAL A 245
 None
 1.00A 3oxwC-1a80A:
undetectable		 3oxwC-1a80A:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P2K_A_SAMA6735_0
(16S RRNA METHYLASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 ALA A 209
ALA A 206
LEU A 223
THR A 251
LEU A 250
 None
 0.98A 3p2kA-1a80A:
undetectable		 3p2kA-1a80A:
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.
3P2K_A_SAMA6735_0
(16S RRNA METHYLASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 ALA A 209
ALA A 206
PHE A 246
THR A 251
LEU A 250
 None
 1.07A 3p2kA-1a80A:
undetectable		 3p2kA-1a80A:
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.
3PHA_B_ACRB701_1
(ALPHA-GLUCOSIDASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 ILE A  72
ILE A 184
ILE A 162
ASP A  45
PHE A 230
 None
None
None
NDP  A 300 ( 3.9A)
NDP  A 300 (-4.7A)
 1.35A 3phaB-1a80A:
8.5		 3phaB-1a80A:
17.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C9N_A_CAMA1419_0
(CYTOCHROME P450)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 THR A  46
LEU A  99
LEU A  97
GLY A  57
 None
 0.78A 4c9nA-1a80A:
0.0		 4c9nA-1a80A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4C9N_A_CAMA1419_0
(CYTOCHROME P450)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 THR A  46
LEU A  99
LEU A  97
VAL A  33
 None
 0.88A 4c9nA-1a80A:
0.0		 4c9nA-1a80A:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX7_B_H4BB600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 8 HIS A 222
GLU A 185
ILE A 162
TRP A 187
 None
None
None
NDP  A 300 ( 3.4A)
 1.37A 4cx7A-1a80A:
0.0
4cx7B-1a80A:
0.0		 4cx7A-1a80A:
19.91
4cx7B-1a80A:
19.91
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.
4EJG_D_NCTD501_1
(CYTOCHROME P450 2A13)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 6 PHE A  71
ASN A  12
ALA A 158
LEU A 106
 None
 0.91A 4ejgD-1a80A:
undetectable		 4ejgD-1a80A:
20.57
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.
4HFP_B_15UB402_1
(PROTHROMBIN)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 12 HIS A 273
ASP A 262
GLU A 163
GLY A 266
GLY A 264
 None
 1.19A 4hfpB-1a80A:
undetectable		 4hfpB-1a80A:
23.00
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.
4V1F_B_BQ1B1087_0
(F0F1 ATP SYNTHASE
SUBUNIT C)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 8 ALA A  59
ALA A  61
ILE A  60
ALA A  95
LEU A  99
 None
 1.13A 4v1fA-1a80A:
0.0
4v1fB-1a80A:
0.0		 4v1fA-1a80A:
18.22
4v1fB-1a80A:
18.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AOX_C_ACTC1001_0
(ALU JO CONSENSUS RNA
SIGNAL RECOGNITION
PARTICLE 14 KDA
PROTEIN)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 TYR A 105
THR A  73
THR A 133
 None
 0.81A 5aoxB-1a80A:
0.0		 5aoxB-1a80A:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AOX_F_ACTF1001_0
(ALU JO CONSENSUS RNA
SIGNAL RECOGNITION
PARTICLE 14 KDA
PROTEIN)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		3 / 3 TYR A 105
THR A  73
THR A 133
 None
 0.82A 5aoxE-1a80A:
0.0		 5aoxE-1a80A:
17.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DNU_A_BEZA319_0
(SHKAI2IB)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 5 GLN A 224
HIS A 222
ILE A 255
ILE A 258
 None
 1.06A 5dnuA-1a80A:
undetectable		 5dnuA-1a80A:
21.43
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.
5DNV_A_BEZA304_0
(SHKAI2IB)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 5 GLN A 224
HIS A 222
ILE A 255
ILE A 258
 None
 1.02A 5dnvA-1a80A:
undetectable		 5dnvA-1a80A:
21.43
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.
5ECM_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 5 THR A  46
ALA A  47
THR A  74
TYR A 105
 None
 1.02A 5ecmA-1a80A:
0.5		 5ecmA-1a80A:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ECO_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 6 THR A  46
ALA A  47
THR A  74
TYR A 105
 None
 0.95A 5ecoA-1a80A:
0.3		 5ecoA-1a80A:
20.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5O96_H_SAMH501_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE E)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 10 LEU A 164
PRO A 166
GLY A 188
GLY A 191
VAL A 218
 None
None
NDP  A 300 (-3.2A)
NDP  A 300 (-4.4A)
None
 0.91A 5o96G-1a80A:
2.0
5o96H-1a80A:
undetectable		 5o96G-1a80A:
22.76
5o96H-1a80A:
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.
5YW0_A_ACTA410_0
(UNCHARACTERIZED
PROTEIN KDOO)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 4 GLY A 137
LEU A 106
VAL A 159
GLU A 185
 None
 1.42A 5yw0A-1a80A:
0.0		 5yw0A-1a80A:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6DJZ_B_GMJB301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		4 / 6 TYR A 105
GLN A 161
GLU A  53
ALA A  89
 None
NDP  A 300 (-3.3A)
None
None
 1.24A 6djzB-1a80A:
0.0		 6djzB-1a80A:
21.68
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.
6H1L_B_FJQB501_0
(BIFUNCTIONAL
CYTOCHROME
P450/NADPH--P450
REDUCTASE)		 1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A
(Corynebacterium
sp.) 		5 / 11 ALA A  91
LEU A  94
VAL A 102
ILE A 136
LEU A 127
 None
 1.29A 6h1lB-1a80A:
undetectable		 6h1lB-1a80A:
22.08