SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5wqs'

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.
1BDW_A_DVAA6_0
(GRAMICIDIN A)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		3 / 3 ALA A  26
VAL A  24
TRP A  56
 None
 0.87A 1bdwA-5wqsA:
undetectable
1bdwB-5wqsA:
undetectable		 1bdwA-5wqsA:
undetectable
1bdwB-5wqsA:
undetectable
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.
1FE2_A_LAXA700_1
(PROSTAGLANDIN
ENDOPEROXIDE H
SYNTHASE-1)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		5 / 10 VAL A  36
PHE A 162
VAL A  55
VAL A  53
LEU A  76
 None
 1.16A 1fe2A-5wqsA:
0.0		 1fe2A-5wqsA:
8.91
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.
1ISM_B_NCAB305_0
(BONE MARROW STROMAL
CELL ANTIGEN 1)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 7 HIS A 275
LEU A 136
ASP A 141
PHE A  93
 None
 1.09A 1ismB-5wqsA:
undetectable		 1ismB-5wqsA:
undetectable
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.
2AOT_B_2PMB401_1
(HISTAMINE
N-METHYLTRANSFERASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		5 / 12 PHE A 264
TYR A 210
CYH A 209
TYR A 190
PHE A 250
 None
 1.46A 2aotB-5wqsA:
0.0		 2aotB-5wqsA:
19.53
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.
2O5Y_H_STRH249_1
(CHIMERIC ANTIBODY
FAB 1E9-DB3)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 7 ASN A 320
GLY A 326
THR A 475
SER A 478
 None
 1.24A 2o5yH-5wqsA:
undetectable
2o5yL-5wqsA:
undetectable		 2o5yH-5wqsA:
17.02
2o5yL-5wqsA:
16.33
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.
2XFF_A_QPSA600_1
(BETA-AMYLASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		11 / 12 ALA A 185
GLU A 187
ARG A 189
TYR A 193
TRP A 199
PHE A 201
SER A 299
GLY A 300
HIS A 302
THR A 344
MET A 348
 None
None
None
None
None
IPA  A 501 ( 4.4A)
None
None
IPA  A 501 (-4.5A)
None
IPA  A 501 ( 4.4A)
 0.73A 2xffA-5wqsA:
61.0		 2xffA-5wqsA:
11.81
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.
2XFF_A_QPSA600_2
(BETA-AMYLASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 4 LYS A 297
TRP A 303
LEU A 385
PRO A 386
 None
 0.68A 2xffA-5wqsA:
61.0		 2xffA-5wqsA:
11.81
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.
4G0U_F_ASWF101_1
(DNA TOPOISOMERASE
2-BETA)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 6 GLY A 300
ALA A 185
GLU A 187
GLN A 353
 None
 1.10A 4g0uA-5wqsA:
undetectable		 4g0uA-5wqsA:
6.86
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.
4LNX_A_T3A502_2
(THYROID HORMONE
RECEPTOR ALPHA)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		3 / 3 ILE A 294
MET A 333
ARG A 336
 None
 0.92A 4lnxA-5wqsA:
undetectable		 4lnxA-5wqsA:
17.50
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.
4XT7_A_TOPA302_1
(RV2671)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		5 / 11 ILE A  90
THR A 419
ASP A  54
GLU A 382
GLU A 187
 None
 1.28A 4xt7A-5wqsA:
undetectable		 4xt7A-5wqsA:
12.84
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.
5BPH_A_ACTA403_0
(D-ALANINE--D-ALANINE
LIGASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 6 TYR A 155
GLY A 139
SER A 137
LEU A 136
 None
 1.12A 5bphA-5wqsA:
undetectable		 5bphA-5wqsA:
undetectable
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.
5BPH_B_ACTB404_0
(D-ALANINE--D-ALANINE
LIGASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 7 TYR A 155
GLY A 139
SER A 137
LEU A 136
 None
 1.07A 5bphB-5wqsA:
undetectable		 5bphB-5wqsA:
undetectable
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.
5BPH_C_ACTC403_0
(D-ALANINE--D-ALANINE
LIGASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 4 TYR A 155
GLY A 139
SER A 137
LEU A 136
 None
 1.12A 5bphC-5wqsA:
undetectable		 5bphC-5wqsA:
undetectable
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.
5BPH_D_ACTD403_0
(D-ALANINE--D-ALANINE
LIGASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 6 TYR A 155
GLY A 139
SER A 137
LEU A 136
 None
 1.06A 5bphD-5wqsA:
undetectable		 5bphD-5wqsA:
undetectable
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.
5MSD_A_BEZA1202_0
(CARBOXYLIC ACID
REDUCTASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 5 ILE A 301
PHE A 201
SER A 359
ALA A 312
 None
IPA  A 501 ( 4.4A)
None
None
 1.16A 5msdA-5wqsA:
2.4		 5msdA-5wqsA:
undetectable
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.
6DWD_A_GLYA715_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 6 GLY A 326
ASN A 320
ASP A 325
SER A 371
 None
 1.13A 6dwdA-5wqsA:
undetectable
6dwdC-5wqsA:
undetectable		 6dwdA-5wqsA:
undetectable
6dwdC-5wqsA:
undetectable
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.
6IBL_A_H98A501_0
(THIOREDOXIN 1,BETA-1
ADRENERGIC RECEPTOR)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		5 / 12 VAL A  53
VAL A  55
ASP A  32
PHE A  77
VAL A  29
 None
 1.48A 6iblA-5wqsA:
undetectable		 6iblA-5wqsA:
undetectable
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.
6MKE_C_FK5C201_0
(PEPTIDYLPROLYL
ISOMERASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 4 ASP A 117
ILE A 112
PRO A 109
LEU A 113
 None
 1.48A 6mkeB-5wqsA:
undetectable		 6mkeB-5wqsA:
22.09
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.
6MKE_D_FK5D201_0
(PEPTIDYLPROLYL
ISOMERASE)		 5wqs BETA-AMYLASE
(Ipomoea
batatas) 		4 / 4 ASP A 117
ILE A 112
PRO A 109
LEU A 113
 None
 1.44A 6mkeA-5wqsA:
undetectable		 6mkeA-5wqsA:
22.09