SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1qs1'

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.
1FDU_D_ESTD352_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 6 VAL A 223
GLY A 222
LEU A 138
GLU A  64
 None
 0.89A 1fduD-1qs1A:
undetectable		 1fduD-1qs1A:
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.
2C8A_A_NCAA1252_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 7 ARG A 349
SER A 386
ARG A 400
GLU A 428
 None
 1.05A 2c8aA-1qs1A:
19.9		 2c8aA-1qs1A:
20.86
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.
2C8A_C_NCAC1252_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 6 ARG A 349
SER A 386
ARG A 400
GLU A 428
 None
 1.04A 2c8aC-1qs1A:
19.4		 2c8aC-1qs1A:
20.86
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.
2C8A_D_NCAD1247_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 7 ARG A 349
SER A 386
ARG A 400
GLU A 428
 None
 1.07A 2c8aD-1qs1A:
19.9		 2c8aD-1qs1A:
20.86
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.
2J2P_B_SC2B1294_1
(FICOLIN-2)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		5 / 9 GLY A 383
LEU A 431
SER A 435
LEU A 459
ASP A 434
 None
 1.44A 2j2pB-1qs1A:
undetectable
2j2pC-1qs1A:
0.0		 2j2pB-1qs1A:
16.85
2j2pC-1qs1A:
16.85
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.
4EYR_B_RITB301_1
(HIV-1 PROTEASE)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 7 LEU A 262
ASP A 267
ILE A 129
THR A 219
 None
 0.91A 4eyrA-1qs1A:
undetectable		 4eyrA-1qs1A:
9.09
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.
4XZK_A_AG2A700_1
(PUTATIVE
NAD(+)--ARGININE
ADP-RIBOSYLTRANSFERA
SE VIS)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 7 SER A 425
ARG A 349
SER A 386
GLU A 428
 None
 1.39A 4xzkA-1qs1A:
12.0		 4xzkA-1qs1A:
18.18
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.
5GLM_A_ACTA613_0
(GLYCOSIDE HYDROLASE
FAMILY 43)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		3 / 3 ASP A 267
SER A 391
TYR A 348
 None
 0.61A 5glmA-1qs1A:
0.0		 5glmA-1qs1A:
21.72
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.
5HI2_A_BAXA801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		5 / 8 ILE A 143
VAL A 207
ILE A 129
ILE A 224
ASP A 189
 None
 1.19A 5hi2A-1qs1A:
undetectable		 5hi2A-1qs1A:
19.66
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.
5JMN_B_FUAB1101_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		4 / 5 ILE A 153
LYS A 263
HIS A 241
VAL A 242
 None
 1.21A 5jmnB-1qs1A:
0.0		 5jmnB-1qs1A:
18.26
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.
6DGX_A_017A101_1
(PROTEASE)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		5 / 12 LEU A 266
VAL A 408
LEU A 459
PRO A 342
ILE A 345
 None
 1.05A 6dgxB-1qs1A:
undetectable		 6dgxB-1qs1A:
10.92
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.
6DH6_A_017A104_1
(PROTEASE)		 1qs1 ADP-RIBOSYLTRANSFERA
SE
(Bacillus
cereus) 		5 / 12 LEU A 266
VAL A 408
LEU A 459
PRO A 342
ILE A 345
 None
 1.02A 6dh6B-1qs1A:
undetectable		 6dh6B-1qs1A:
10.92