SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3kwe'

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.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 12 HIS A 107
GLY A 108
ASN A 126
GLY A  80
VAL A  92
 ZN  A 194 (-3.4A)
None
None
None
None
 1.19A 1ffyA-3kweA:
undetectable		 1ffyA-3kweA:
11.40
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.
1J3J_A_CP6A609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 10 ALA A  54
SER A  32
ILE A  46
ILE A  74
THR A  58
 None
 1.18A 1j3jA-3kweA:
undetectable		 1j3jA-3kweA:
19.72
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.
1J3J_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 9 ALA A  54
SER A  32
ILE A  46
ILE A  74
THR A  58
 None
 1.22A 1j3jB-3kweA:
undetectable		 1j3jB-3kweA:
19.72
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.
1SDV_B_MK1B902_1
(PROTEASE RETROPEPSIN)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 10 ALA A 127
ILE A 112
GLY A 113
GLY A 130
ILE A 141
 None
 0.82A 1sdvA-3kweA:
undetectable		 1sdvA-3kweA:
20.10
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.
2AVV_E_MK1E902_1
(POL POLYPROTEIN)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 12 ALA A 127
ILE A 112
GLY A 113
GLY A 130
ILE A 141
 None
 0.75A 2avvD-3kweA:
undetectable		 2avvD-3kweA:
20.10
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.
3N3I_A_ROCA201_2
(PROTEASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		4 / 6 ILE A 141
PRO A 168
ILE A 175
VAL A  98
 None
 0.96A 3n3iA-3kweA:
undetectable		 3n3iA-3kweA:
21.89
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.
3NU4_B_478B401_1
(PROTEASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 9 ALA A 110
ILE A  94
GLY A 130
ILE A 146
ILE A 106
 None
 1.07A 3nu4A-3kweA:
undetectable		 3nu4A-3kweA:
19.60
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.
3QGT_B_CP6B609_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 10 ALA A  54
SER A  32
ILE A  46
ILE A  74
THR A  58
 None
 1.23A 3qgtB-3kweA:
undetectable		 3qgtB-3kweA:
12.17
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.
4A9K_B_TYLB2198_1
(CREB-BINDING PROTEIN)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		4 / 5 VAL A  38
LEU A  34
ILE A  52
VAL A  44
 None
 0.99A 4a9kB-3kweA:
undetectable		 4a9kB-3kweA:
20.48
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.
4FZV_A_SAMA401_0
(PUTATIVE
METHYLTRANSFERASE
NSUN4)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 12 PRO A 109
GLY A 108
GLY A  76
ASP A 114
GLY A  95
 None
 1.08A 4fzvA-3kweA:
undetectable		 4fzvA-3kweA:
20.30
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.
4LV9_A_20JA602_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		4 / 7 VAL A 135
ILE A 146
ARG A 128
ALA A 127
 None
 0.85A 4lv9A-3kweA:
undetectable		 4lv9A-3kweA:
16.60
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.
5WWS_B_SAMB501_0
(PUTATIVE
METHYLTRANSFERASE
NSUN6)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		5 / 12 ALA A 110
PRO A 109
GLY A  76
ASP A 114
GLY A  95
 None
 1.24A 5wwsB-3kweA:
undetectable		 5wwsB-3kweA:
18.90
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.
6HU9_Q_PCFQ202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 3kwe CARBON DIOXIDE
CONCENTRATING
MECHANISM PROTEIN
(Thermosynechococ
cus
elongatus) 		4 / 6 ILE A 146
ALA A 127
ARG A 128
ASP A  85
 None
 1.06A 6hu9m-3kweA:
undetectable
6hu9q-3kweA:
undetectable		 6hu9m-3kweA:
15.89
6hu9q-3kweA:
21.96