SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4xk2'

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.
1SN5_D_T3D602_1
(TRANSTHYRETIN)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 12 LEU A 220
VAL A 211
LEU A 277
LEU A 274
VAL A 254
 None
 1.07A 1sn5B-4xk2A:
undetectable
1sn5D-4xk2A:
undetectable		 1sn5B-4xk2A:
18.54
1sn5D-4xk2A:
18.54
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.
1SN5_D_T3D602_1
(TRANSTHYRETIN)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 12 LEU A 277
LEU A 274
VAL A 254
LEU A 220
VAL A 211
 None
 1.07A 1sn5B-4xk2A:
undetectable
1sn5D-4xk2A:
undetectable		 1sn5B-4xk2A:
18.54
1sn5D-4xk2A:
18.54
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.
2NNH_A_9CRA501_1
(CYTOCHROME P450 2C8)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 11 ILE A 210
ALA A 182
VAL A  13
PRO A  14
ILE A  83
 None
 1.09A 2nnhA-4xk2A:
undetectable		 2nnhA-4xk2A:
21.30
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.
3IV6_C_SAMC301_0
(PUTATIVE
ZN-DEPENDENT ALCOHOL
DEHYDROGENASE)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 12 THR A  86
PHE A  18
ILE A  45
ARG A 116
LEU A  71
 None
 1.22A 3iv6C-4xk2A:
undetectable		 3iv6C-4xk2A:
25.21
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.
3KP5_B_KANB2002_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		3 / 3 ALA A  74
ARG A  78
LYS A  81
 None
 1.09A 3kp5B-4xk2A:
2.1		 3kp5B-4xk2A:
16.96
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.
4DUB_A_LDPA501_1
(CYTOCHROME P450 BM3
VARIANT 9D7)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		4 / 6 PHE A  56
ALA A  82
GLY A  52
LEU A  49
 None
 0.98A 4dubA-4xk2A:
undetectable		 4dubA-4xk2A:
22.97
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.
5KBW_A_RBFA201_1
(RIBOFLAVIN
TRANSPORTER RIBU)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 12 GLY A 301
MET A 297
ASN A 299
LEU A 296
ALA A  51
 None
 1.43A 5kbwA-4xk2A:
undetectable		 5kbwA-4xk2A:
21.28
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.
5KQX_A_ROCA101_2
(PROTEASE E35D-SQV)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 9 ARG A 116
LEU A 117
VAL A 152
ILE A 155
ILE A 122
 None
 1.14A 5kqxB-4xk2A:
undetectable		 5kqxB-4xk2A:
16.37
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.
5VC0_A_RITA602_1
(CYTOCHROME P450 3A4)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 12 PHE A 160
LEU A  88
ILE A 155
ILE A 210
ALA A 209
 None
 1.09A 5vc0A-4xk2A:
undetectable		 5vc0A-4xk2A:
21.13
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.
5X7P_B_ACRB1401_1
(GLYCOSIDE HYDROLASE
FAMILY 31
ALPHA-GLUCOSIDASE)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		5 / 9 GLN A 126
GLN A 184
ILE A 288
GLY A   7
SER A   9
 None
 1.43A 5x7pA-4xk2A:
0.9		 5x7pA-4xk2A:
14.33
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.
6DHB_A_BEZA202_0
(HEPATITIS A VIRUS
CELLULAR RECEPTOR 2)		 4xk2 ALDO/KETO REDUCTASE
(Polaromonas
sp.
JS666) 		4 / 6 ARG A 225
ILE A 272
MET A 258
ASP A 259
 None
 1.48A 6dhbA-4xk2A:
undetectable		 6dhbA-4xk2A:
13.37