SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5jwr'

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.
1DG5_A_TOPA201_1
(DIHYDROFOLATE
REDUCTASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		6 / 11 ILE A 244
ILE A 223
PHE A  56
LEU A  37
PRO A  38
ILE A  26
 None
 1.49A 1dg5A-5jwrA:
undetectable		 1dg5A-5jwrA:
23.08
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.
2G70_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 PHE A 195
VAL A 151
ALA A 169
PHE A 166
VAL A 161
 None
 1.32A 2g70A-5jwrA:
undetectable		 2g70A-5jwrA:
22.04
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.
2G70_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 PHE A 195
VAL A 151
ALA A 169
PHE A 166
VAL A 161
 None
 1.32A 2g70B-5jwrA:
2.8		 2g70B-5jwrA:
22.04
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.
2G72_A_SAMA2001_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 PHE A 195
VAL A 151
ALA A 169
PHE A 166
VAL A 161
 None
 1.35A 2g72A-5jwrA:
2.5		 2g72A-5jwrA:
22.04
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.
2W3A_A_TOPA1190_1
(DIHYDROFOLATE
REDUCTASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 11 ILE A 207
ALA A 193
THR A  43
ILE A 180
VAL A 206
 None
 1.25A 2w3aA-5jwrA:
2.1		 2w3aA-5jwrA:
23.28
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.
2ZJ0_B_2FAB500_2
(ADENOSYLHOMOCYSTEINA
SE)		 5jwr CIRCADIAN CLOCK
PROTEIN KAIA
(Thermosynechococ
cus
elongatus) 		4 / 5 LEU E 239
GLN E 246
THR E 242
THR E 199
 None
 1.34A 2zj0B-5jwrE:
undetectable		 2zj0B-5jwrE:
14.75
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.
2ZJ0_D_2FAD500_2
(ADENOSYLHOMOCYSTEINA
SE)		 5jwr CIRCADIAN CLOCK
PROTEIN KAIA
(Thermosynechococ
cus
elongatus) 		4 / 4 LEU E 239
GLN E 246
THR E 242
THR E 199
 None
 1.32A 2zj0D-5jwrE:
undetectable		 2zj0D-5jwrE:
14.75
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.
3HEG_A_BAXA1_2
(MITOGEN-ACTIVATED
PROTEIN KINASE 14)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		4 / 6 VAL A 206
ILE A  32
HIS A 231
LEU A 224
 None
 0.70A 3hegA-5jwrA:
undetectable		 3hegA-5jwrA:
19.94
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.
3KP2_A_PNNA5001_0
(TRANSCRIPTIONAL
REGULATOR TCAR)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		4 / 8 THR A  43
LEU A  37
SER A  33
HIS A 231
 None
 1.03A 3kp2A-5jwrA:
undetectable
3kp2B-5jwrA:
undetectable		 3kp2A-5jwrA:
21.15
3kp2B-5jwrA:
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.
4M2X_A_TMQA202_1
(DIHYDROFOLATE
REDUCTASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		6 / 12 ILE A 244
ILE A 223
PHE A  56
LEU A  37
PRO A  38
ILE A  26
 None
 1.48A 4m2xA-5jwrA:
undetectable		 4m2xA-5jwrA:
25.65
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.
4N09_A_ADNA401_1
(ADENOSINE KINASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 ASN A 245
LEU A  55
GLY A  28
GLY A  36
ASP A  30
 None
 1.05A 4n09A-5jwrA:
4.6		 4n09A-5jwrA:
22.28
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.
4N09_B_ADNB401_1
(ADENOSINE KINASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 ASN A 245
LEU A  55
GLY A  28
GLY A  36
ASP A  30
 None
 1.02A 4n09B-5jwrA:
4.6		 4n09B-5jwrA:
22.28
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.
4NKV_D_AERD601_1
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		5 / 12 PHE A  56
ILE A  32
ILE A 223
GLY A  36
VAL A 206
 None
 0.93A 4nkvD-5jwrA:
undetectable		 4nkvD-5jwrA:
20.39
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.
5A06_D_SORD1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
CIRCADIAN CLOCK
PROTEIN KAIB
(Thermosynechococ
cus
elongatus;
Thermosynechococ
cus
elongatus) 		4 / 5 ALA B  15
ARG A 167
ALA A 126
GLU A 164
 None
 1.47A 5a06C-5jwrB:
undetectable
5a06D-5jwrB:
undetectable		 5a06C-5jwrB:
16.19
5a06D-5jwrB:
16.19
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.
5YK2_A_ERYA501_0
(PROBABLE CONSERVED
ATP-BINDING PROTEIN
ABC TRANSPORTER)		 5jwr CIRCADIAN CLOCK
PROTEIN KINASE KAIC
CIRCADIAN CLOCK
PROTEIN KAIB
(Thermosynechococ
cus
elongatus;
Thermosynechococ
cus
elongatus) 		5 / 11 GLU B  84
ARG B  83
GLY A 120
ASP B  79
ALA A 119
 None
 1.15A 5yk2A-5jwrB:
undetectable		 5yk2A-5jwrB:
13.20
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.
6G9B_B_IXXB705_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN
ENVELOPE
GLYCOPROTEIN)		 5jwr CIRCADIAN CLOCK
PROTEIN KAIB
CIRCADIAN CLOCK
PROTEIN KINASE KAIC
(Thermosynechococ
cus
elongatus) 		4 / 5 ARG A 130
ALA A 126
GLN A 116
ILE B  77
 None
 1.36A 6g9bA-5jwrA:
undetectable
6g9bB-5jwrA:
undetectable		 6g9bA-5jwrA:
16.07
6g9bB-5jwrA:
14.80