SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'S2N'


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.
2V0M_C_KLNC1499_1
(CYTOCHROME P450 3A4)
3i3a ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Leptospira
interrogans)
4 / 7 SER A  49
PHE A  88
ILE A  45
GLY A 119
None
None
None
S2N  A 260 ( 3.8A)
1.02A 2v0mC-3i3aA:
undetectable
2v0mC-3i3aA:
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.
3UQ6_A_ADNA401_1
(ADENOSINE KINASE,
PUTATIVE)
3i3a ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Leptospira
interrogans)
5 / 12 ILE A 106
GLY A 138
GLY A 119
LEU A 130
GLY A  97
None
S2N  A 260 (-3.8A)
S2N  A 260 ( 3.8A)
None
None
1.01A 3uq6A-3i3aA:
undetectable
3uq6A-3i3aA:
22.31
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.
3VAS_A_ADNA401_1
(PUTATIVE ADENOSINE
KINASE)
3i3a ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Leptospira
interrogans)
5 / 12 ILE A 106
GLY A 138
GLY A 119
LEU A 130
GLY A  97
None
S2N  A 260 (-3.8A)
S2N  A 260 ( 3.8A)
None
None
1.01A 3vasA-3i3aA:
undetectable
3vasA-3i3aA:
22.43
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.
4QWP_B_GCSB307_1
(CHITOSANASE)
3i3a ACYL-[ACYL-CARRIER-P
ROTEIN]--UDP-N-ACETY
LGLUCOSAMINE
O-ACYLTRANSFERASE

(Leptospira
interrogans)
4 / 7 THR A 104
GLY A  97
THR A  80
HIS A 117
None
None
None
S2N  A 260 (-3.9A)
0.92A 4qwpB-3i3aA:
undetectable
4qwpB-3i3aA:
23.15