SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r1i'

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.
1HK1_A_T44A3003_1
(SERUM ALBUMIN)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		4 / 6 ILE A  55
LYS A  25
ALA A  19
VAL A  38
 None
 0.98A 1hk1A-3r1iA:
undetectable		 1hk1A-3r1iA:
17.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBI_D_SAMD3293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		5 / 12 TYR A 163
THR A 146
ALA A 168
SER A 166
GLY A 194
 EDO  A 257 ( 4.3A)
None
None
None
None
 1.31A 1nbiD-3r1iA:
7.1		 1nbiD-3r1iA:
22.36
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.
2EFJ_A_37TA502_1
(3,7-DIMETHYLXANTHINE
METHYLTRANSFERASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		5 / 12 LEU A 233
TYR A 230
ILE A  23
ILE A 196
ILE A 248
 None
 1.25A 2efjA-3r1iA:
4.4		 2efjA-3r1iA:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2UVN_B_ECNB1406_1
(CYTOCHROME P450 130)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		5 / 11 ASP A  73
THR A 118
GLY A 122
THR A 126
VAL A  75
 None
 1.27A 2uvnB-3r1iA:
undetectable		 2uvnB-3r1iA:
22.22
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.
3P97_C_SAMC263_0
(NON-STRUCTURAL
PROTEIN 5)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.34A 3p97C-3r1iA:
5.4		 3p97C-3r1iA:
23.62
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.
4CTJ_A_SAMA1263_0
(NON-STRUCTURAL
PROTEIN 5)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.33A 4ctjA-3r1iA:
5.7		 4ctjA-3r1iA:
20.90
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.
4NPT_A_017A401_1
(PROTEASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		5 / 9 ALA A  36
ILE A  89
GLY A  88
MET A 134
THR A 142
 None
 1.09A 4nptA-3r1iA:
undetectable		 4nptA-3r1iA:
15.16
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.
4WNU_C_QDNC602_1
(CYTOCHROME P450 2D6)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		5 / 11 LEU A   9
GLY A 228
LEU A 229
PHE A   7
ALA A 237
 None
 1.19A 4wnuC-3r1iA:
undetectable		 4wnuC-3r1iA:
22.32
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.
5EC8_C_SAMC4000_0
(GENOME POLYPROTEIN)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.31A 5ec8C-3r1iA:
5.2		 5ec8C-3r1iA:
20.90
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.
5IWU_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		4 / 6 GLY A  97
ASP A 245
ILE A 248
TYR A 230
 None
 1.00A 5iwuA-3r1iA:
undetectable		 5iwuA-3r1iA:
20.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KQR_A_SAMA301_0
(METHYLTRANSFERASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.35A 5kqrA-3r1iA:
5.7		 5kqrA-3r1iA:
24.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KQS_A_SAMA307_0
(GENOME POLYPROTEIN)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.33A 5kqsA-3r1iA:
5.5		 5kqsA-3r1iA:
24.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M5B_A_SAMA1001_0
(NS5
METHYLTRANSFERASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.34A 5m5bA-3r1iA:
5.4		 5m5bA-3r1iA:
26.07
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.
5WZ2_A_SAMA601_0
(NS5 MTASE)		 3r1i SHORT-CHAIN TYPE
DEHYDROGENASE/REDUCT
ASE
(Mycobacterium
marinum) 		6 / 12 GLY A  22
GLY A  97
GLY A  18
GLY A  24
ASP A 117
ILE A  98
 None
 1.31A 5wz2A-3r1iA:
5.7		 5wz2A-3r1iA:
24.84