SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3qnw'

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.
1QCA_A_FUAA221_1
(TYPE III
CHLORAMPHENICOL
ACETYLTRANSFERASE)		 3qnw CASPASE-6
(Homo
sapiens) 		4 / 7 CYH A 148
PHE B 206
SER A 150
PHE A 114
 None
 1.09A 1qcaA-3qnwA:
undetectable		 1qcaA-3qnwA:
24.41
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.
2LBD_A_REAA500_1
(RETINOIC ACID
RECEPTOR GAMMA)		 3qnw CASPASE-6
(Homo
sapiens) 		5 / 12 PHE B 288
LYS B 285
ILE A 157
PHE B 245
GLY A  45
 None
 1.24A 2lbdA-3qnwB:
undetectable		 2lbdA-3qnwB:
15.65
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.
2WEY_B_EV1B1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)		 3qnw CASPASE-6
(Homo
sapiens) 		4 / 8 LEU B 232
VAL A 115
ILE A  49
PHE A  78
 None
 0.98A 2weyB-3qnwB:
undetectable		 2weyB-3qnwB:
15.50
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.
3NY4_A_SMXA310_1
(BETA-LACTAMASE)		 3qnw CASPASE-6
(Homo
sapiens) 		4 / 8 LEU B 286
ALA A  34
GLY A 153
PRO A 155
 None
 0.94A 3ny4A-3qnwB:
undetectable		 3ny4A-3qnwB:
15.21
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.
4FEV_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3qnw CASPASE-6
(Homo
sapiens) 		5 / 10 GLN B 274
SER B 218
ASN A  73
GLU B 234
ASP A  70
 None
 1.36A 4fevA-3qnwB:
undetectable		 4fevA-3qnwB:
14.83
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.
4PGF_A_ADNA502_1
(ADENOSYLHOMOCYSTEINA
SE)		 3qnw CASPASE-6
(Homo
sapiens) 		5 / 12 ASP A  90
GLU A 135
ASN A 125
GLY A 124
PHE A 118
 None
 1.32A 4pgfA-3qnwA:
2.3		 4pgfA-3qnwA:
16.44
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.
5HIE_B_P06B801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3qnw CASPASE-6
(Homo
sapiens) 		4 / 7 ILE A  46
GLY A  45
LEU B 232
CYH A  87
 None
 0.57A 5hieB-3qnwA:
undetectable		 5hieB-3qnwA:
16.50
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.
5HRQ_I_IPHI101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 3qnw CASPASE-6
CASPASE-6
(Homo
sapiens;
Homo
sapiens) 		4 / 6 VAL A 117
LEU A 119
CYH B 209
LEU B 232
 None
 1.10A 5hrqB-3qnwA:
undetectable
5hrqI-3qnwA:
undetectable
5hrqJ-3qnwA:
undetectable		 5hrqB-3qnwA:
14.29
5hrqI-3qnwA:
9.84
5hrqJ-3qnwA:
14.29
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.
6MN4_F_AM2F301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3qnw CASPASE-6
(Homo
sapiens) 		4 / 7 ARG B 259
HIS B 219
ASP B 231
GLU B 234
 None
 1.38A 6mn4F-3qnwB:
undetectable		 6mn4F-3qnwB:
15.44