SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qhs'

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.
2LH6_A_NIOA155_1
(LEGHEMOGLOBIN A
(NICOTINATE MET))		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		4 / 5 PHE A   3
PHE A 201
PHE A 153
VAL A   5
 None
 1.17A 2lh6A-2qhsA:
undetectable		 2lh6A-2qhsA:
23.21
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.
2Q9R_A_BEZA203_0
(PROTEIN OF UNKNOWN
FUNCTION)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		4 / 5 LEU A 155
GLY A  89
ILE A 106
ILE A 110
 None
 0.80A 2q9rA-2qhsA:
undetectable		 2q9rA-2qhsA:
23.74
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.
3A51_E_VDYE6178_1
(VITAMIN D
HYDROXYLASE)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 THR A  80
ASN A 156
ALA A 143
VAL A  99
LEU A 103
 OCA  A3913 ( 3.8A)
None
None
None
None
 1.22A 3a51E-2qhsA:
undetectable		 3a51E-2qhsA:
21.93
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.
3CCF_B_BEZB261_0
(CYCLOPROPANE-FATTY-A
CYL-PHOSPHOLIPID
SYNTHASE)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		4 / 8 HIS A  82
ILE A  45
PHE A 164
ARG A  75
 OCA  A3913 ( 4.7A)
None
None
OCA  A3913 (-3.6A)
 1.28A 3ccfB-2qhsA:
undetectable		 3ccfB-2qhsA:
21.77
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.
3DH0_A_SAMA220_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 GLY A 152
GLY A 141
SER A 149
ALA A 154
LEU A  36
 OCA  A3913 (-4.3A)
OCA  A3913 (-3.9A)
None
OCA  A3913 ( 4.1A)
None
 1.40A 3dh0A-2qhsA:
undetectable		 3dh0A-2qhsA:
24.03
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.
4A9K_B_TYLB2198_1
(CREB-BINDING PROTEIN)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		4 / 5 VAL A 142
LEU A 103
ILE A 106
VAL A  95
 None
 0.94A 4a9kB-2qhsA:
undetectable		 4a9kB-2qhsA:
18.49
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.
4J6D_A_TESA503_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 PHE A 102
PHE A  93
ALA A 109
VAL A   5
LEU A  38
 None
 1.11A 4j6dA-2qhsA:
undetectable		 4j6dA-2qhsA:
21.80
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.
4J6D_B_TESB502_1
(CYTOCHROME P450
MONOOXYGENASE)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 PHE A 102
PHE A  93
ALA A 109
VAL A   5
LEU A  38
 None
 1.11A 4j6dB-2qhsA:
undetectable		 4j6dB-2qhsA:
21.80
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.
4WNW_A_RTZA602_1
(CYTOCHROME P450 2D6)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 12 LEU A   4
GLY A   9
LEU A  39
VAL A  88
VAL A  23
 None
 1.20A 4wnwA-2qhsA:
undetectable		 4wnwA-2qhsA:
21.52
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.
5JQB_B_IBPB706_1
(ENVELOPE
GLYCOPROTEIN
1,ENVELOPE
GLYCOPROTEIN
1,ENVELOPE
GLYCOPROTEIN 1
ENVELOPE
GLYCOPROTEIN 2)		 2qhs LIPOYLTRANSFERASE
(Thermus
thermophilus) 		5 / 8 ALA A 200
LEU A  87
LEU A 155
LEU A  36
LEU A  38
 None
 1.42A 5jqbA-2qhsA:
undetectable
5jqbB-2qhsA:
undetectable		 5jqbA-2qhsA:
21.69
5jqbB-2qhsA:
16.60