SIMILAR PATTERNS OF AMINO ACIDS FOR 2A3B_A_CFFA1433

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1d2k CHITINASE 1

(Coccidioides
immitis) 		PF00704
(Glyco_hydro_18) 		4 TRP A 131
TYR A 172
MET A 237
ASP A 240
 None
 0.49A 2a3bA-1d2kA:
65.0		 2a3bA-1d2kA:
59.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1itx GLYCOSYL HYDROLASE

(Bacillus
circulans) 		PF00704
(Glyco_hydro_18) 		4 TRP A 164
TYR A 205
MET A 277
ASP A 280
 None
None
GOL  A1007 ( 3.3A)
None
 0.88A 2a3bA-1itxA:
47.8		 2a3bA-1itxA:
33.95
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1wno CHITINASE

(Aspergillus
fumigatus) 		PF00704
(Glyco_hydro_18) 		5 TRP A  99
TYR A 140
MET A 205
ASP A 208
PHE A 213
 None
 0.51A 2a3bA-1wnoA:
69.7		 2a3bA-1wnoA:
99.75
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.
3cyv UROPORPHYRINOGEN
DECARBOXYLASE

(Shigella
flexneri) 		PF01208
(URO-D) 		4 TYR A 123
MET A  47
ASP A  77
PHE A 144
 None
 0.95A 2a3bA-3cyvA:
9.7		 2a3bA-3cyvA:
21.88
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.
3fnd CHITINASE

(Bacteroides
thetaiotaomicron) 		PF00704
(Glyco_hydro_18) 		4 TYR A 159
MET A 211
ASP A 214
PHE A 218
 None
 1.19A 2a3bA-3fndA:
31.5		 2a3bA-3fndA:
24.49
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3g6l CHITINASE

(Clonostachys
rosea) 		PF00704
(Glyco_hydro_18) 		4 TRP A 134
TYR A 175
MET A 240
ASP A 243
 None
 0.61A 2a3bA-3g6lA:
63.7		 2a3bA-3g6lA:
54.52
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.
3w4r CHITINASE

(Ostrinia
furnacalis) 		PF00704
(Glyco_hydro_18) 		4 TRP A 107
TYR A 149
MET A 215
ASP A 218
 None
 0.70A 2a3bA-3w4rA:
44.0		 2a3bA-3w4rA:
25.12
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.
4dws CHI2

(Yersinia
entomophaga) 		PF00704
(Glyco_hydro_18) 		4 TRP A 308
TYR A 350
MET A 422
ASP A 425
 None
 0.98A 2a3bA-4dwsA:
33.8		 2a3bA-4dwsA:
26.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4q22 GLYCOSIDE HYDROLASE
FAMILY 18

(Serratia
proteamaculans) 		PF00704
(Glyco_hydro_18) 		4 TRP A 114
TYR A 154
MET A 220
ASP A 223
 None
None
ACT  A 502 ( 3.1A)
GOL  A 504 (-2.7A)
 0.69A 2a3bA-4q22A:
37.6		 2a3bA-4q22A:
30.79
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.
5f84 O-GLUCOSYLTRANSFERAS
E RUMI

(Drosophila
melanogaster) 		PF05686
(Glyco_transf_90) 		4 TRP A 184
TYR A 181
ASP A 151
PHE A 122
 None
None
BGC  B 101 (-2.9A)
None
 1.19A 2a3bA-5f84A:
undetectable		 2a3bA-5f84A:
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		4 TRP B 652
TYR B 692
MET B 764
ASP B 767
 None
 0.73A 2a3bA-5gztB:
41.5		 2a3bA-5gztB:
18.77
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.
5gzu CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18) 		4 TRP A 652
TYR A 692
MET A 764
ASP A 767
 None
 0.71A 2a3bA-5gzuA:
41.2		 2a3bA-5gzuA:
20.29
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.
5l0v PROTEIN
O-GLUCOSYLTRANSFERAS
E 1

(Homo sapiens) 		PF05686
(Glyco_transf_90) 		4 TRP A 164
TYR A 161
ASP A 133
PHE A 104
 None
 1.20A 2a3bA-5l0vA:
undetectable		 2a3bA-5l0vA:
20.63