SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ay3'

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.
1HWI_A_115A2_2
(HMG-COA REDUCTASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 8 CYH A  49
HIS A  69
LEU A  93
ALA A  96
 None
 0.90A 1hwiB-3ay3A:
undetectable		 1hwiB-3ay3A:
21.64
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.
1HWI_C_115C4_2
(HMG-COA REDUCTASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 8 CYH A  49
HIS A  69
LEU A  93
ALA A  96
 None
 0.88A 1hwiD-3ay3A:
undetectable		 1hwiD-3ay3A:
21.64
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.
1HWI_D_115D3_1
(HMG-COA REDUCTASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 8 CYH A  49
HIS A  69
LEU A  93
ALA A  96
 None
 0.88A 1hwiC-3ay3A:
undetectable		 1hwiC-3ay3A:
21.64
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.
1T03_P_TFOP822_1
(POL POLYPROTEIN
SYNTHETIC
OLIGONUCLEOTIDE
PRIMER)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 7 ASP A 227
MET A 185
ASP A 182
ASP A 183
 None
 1.47A 1t03A-3ay3A:
undetectable		 1t03A-3ay3A:
17.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UOB_A_PNNA1311_1
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		3 / 3 ARG A   4
ARG A  30
ILE A  67
 None
 0.64A 1uobA-3ay3A:
undetectable		 1uobA-3ay3A:
21.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FT9_A_CHDA131_0
(FATTY ACID-BINDING
PROTEIN 2, LIVER)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 11 LEU A   5
LEU A  25
ILE A 105
ASN A 159
LEU A  31
 None
 1.36A 2ft9A-3ay3A:
undetectable		 2ft9A-3ay3A:
17.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IGT_A_SAMA1001_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 12 PHE A 192
PHE A 107
ALA A  97
GLY A  71
GLY A  89
 None
 1.05A 2igtA-3ay3A:
5.2		 2igtA-3ay3A:
21.93
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.
2IGT_B_SAMB1002_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 12 PHE A 192
PHE A 107
ALA A  97
GLY A  71
GLY A  89
 None
 1.03A 2igtB-3ay3A:
5.2		 2igtB-3ay3A:
21.93
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.
2XN6_A_T44A1370_1
(THYROXINE-BINDING
GLOBULIN)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 10 LEU A 197
LEU A 221
LEU A 187
LEU A 158
ARG A 104
 None
 1.14A 2xn6A-3ay3A:
undetectable
2xn6B-3ay3A:
undetectable		 2xn6A-3ay3A:
22.01
2xn6B-3ay3A:
8.68
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.
2XN7_A_T44A1355_1
(THYROXINE-BINDING
GLOBULIN)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 10 LEU A 197
LEU A 221
LEU A 187
LEU A 158
ARG A 104
 None
 1.07A 2xn7A-3ay3A:
undetectable
2xn7B-3ay3A:
undetectable		 2xn7A-3ay3A:
22.01
2xn7B-3ay3A:
8.68
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.
2ZUJ_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 8 THR A   8
LEU A   6
VAL A  61
LEU A  51
 None
 0.86A 2zujA-3ay3A:
undetectable		 2zujA-3ay3A:
21.53
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.
3AVP_A_MV2A313_1
(PANTOTHENATE KINASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 7 VAL A 201
ASP A 144
TYR A 203
ILE A 123
 None
 0.96A 3avpA-3ay3A:
undetectable		 3avpA-3ay3A:
23.24
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.
3FL9_D_TOPD200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 9 ALA A 191
LEU A  25
VAL A 106
ILE A  18
LEU A  70
 None
 1.14A 3fl9D-3ay3A:
undetectable		 3fl9D-3ay3A:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FL9_D_TOPD200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 9 ALA A 191
LEU A  25
VAL A 106
LEU A  70
PHE A 184
 None
 1.45A 3fl9D-3ay3A:
undetectable		 3fl9D-3ay3A:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FL9_E_TOPE200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 10 LEU A  25
VAL A 106
ILE A  18
LEU A  70
PHE A 184
 None
 1.13A 3fl9E-3ay3A:
undetectable		 3fl9E-3ay3A:
19.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XTA_A_DIFA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 9 SER A  32
ALA A  10
LEU A   5
ILE A  67
 None
 0.90A 4xtaA-3ay3A:
undetectable		 4xtaA-3ay3A:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MRA_B_DM2B204_1
(SORCIN)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 6 TYR A 252
ARG A 130
ASP A 132
GLY A 254
 None
 0.95A 5mraA-3ay3A:
undetectable
5mraB-3ay3A:
undetectable		 5mraA-3ay3A:
20.45
5mraB-3ay3A:
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.
5UMX_B_RBFB202_1
(GLYOXALASE/BLEOMYCIN
RESISANCE
PROTEIN/DIOXYGENASE)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 10 TRP A 212
ASN A 208
GLY A 115
HIS A 112
TRP A 213
 None
 1.49A 5umxA-3ay3A:
0.0
5umxB-3ay3A:
0.0		 5umxA-3ay3A:
18.34
5umxB-3ay3A:
18.34
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.
5WGQ_A_ESTA601_1
(ESTROGEN RECEPTOR)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		5 / 9 LEU A   2
MET A   1
GLY A  23
HIS A  43
LEU A  22
 None
 1.44A 5wgqA-3ay3A:
undetectable		 5wgqA-3ay3A:
15.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6HU9_Q_PCFQ202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 6 TYR A 149
ILE A 155
ALA A  96
ARG A  98
 None
 1.12A 6hu9m-3ay3A:
undetectable
6hu9q-3ay3A:
undetectable		 6hu9m-3ay3A:
19.25
6hu9q-3ay3A:
20.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6JI6_A_ACTA305_0
(GLUTATHIONE
S-TRANSFERASE
CLASS-MU 26 KDA
ISOZYME)		 3ay3 NAD-DEPENDENT
EPIMERASE/DEHYDRATAS
E
(Chromohalobacter
salexigens) 		4 / 5 GLY A  71
LEU A  70
SER A  74
TYR A 135
 None
 1.20A 6ji6A-3ay3A:
undetectable		 6ji6A-3ay3A:
25.00