SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1pqw'

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.
1P6K_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 GLY A 123
GLN A 125
VAL A  93
ALA A 119
 None
 0.95A 1p6kA-1pqwA:
undetectable		 1p6kA-1pqwA:
20.39
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.
3ELZ_A_CHDA151_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 ILE A  44
GLY A  49
TYR A  23
LEU A  82
 None
 0.73A 3elzA-1pqwA:
0.0		 3elzA-1pqwA:
20.00
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.
3GN8_B_DEXB247_1
(GLUCOCORTICOID
RECEPTOR 2)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 115
ASN A 113
GLY A 137
VAL A 111
PHE A 133
 None
 1.42A 3gn8B-1pqwA:
0.0		 3gn8B-1pqwA:
20.82
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.
3HRD_B_NIOB5661_1
(NICOTINATE
DEHYDROGENASE LARGE
MOLYBDOPTERIN
SUBUNIT
NICOTINATE
DEHYDROGENASE MEDIUM
MOLYBDOPTERIN
SUBUNIT)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 ILE A  66
ALA A  59
LEU A 193
ALA A  26
 None
 0.76A 3hrdA-1pqwA:
undetectable
3hrdB-1pqwA:
undetectable		 3hrdA-1pqwA:
19.95
3hrdB-1pqwA:
20.00
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.
4M11_D_MXMD606_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A  51
ILE A 134
VAL A 161
LEU A 136
LEU A  30
 None
 1.42A 4m11D-1pqwA:
undetectable		 4m11D-1pqwA:
16.18
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.
4MBS_B_MRVB1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 TYR A  86
LEU A 136
THR A  48
MET A  53
 None
 1.34A 4mbsB-1pqwA:
undetectable		 4mbsB-1pqwA:
17.75
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.
4RTS_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 1pqw POLYKETIDE SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 107
GLY A 131
ILE A 134
SER A  29
TYR A  67
 None
 1.13A 4rtsA-1pqwA:
5.7		 4rtsA-1pqwA:
20.34