SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ITT'


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.
4HB6_A_DXCA75_0
(PPCA)		 2j4e INOSINE TRIPHOSPHATE
PYROPHOSPHATASE
(Homo
sapiens) 		4 / 8 ILE A 140
LEU A 104
ILE A  88
GLY A  81
 None
None
ITT  A1001 ( 4.8A)
None
 0.79A 4hb6A-2j4eA:
undetectable		 4hb6A-2j4eA:
17.26
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.
4YV5_B_SVRB207_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 2j4e INOSINE TRIPHOSPHATE
PYROPHOSPHATASE
(Homo
sapiens) 		4 / 7 ASN A  16
LYS A  18
LYS A  19
LEU A  35
 ITT  A1001 (-3.9A)
None
ITT  A1001 (-2.7A)
None
 1.10A 4yv5B-2j4eA:
undetectable		 4yv5B-2j4eA:
19.61
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.
4YV5_B_SVRB207_2
(BASIC PHOSPHOLIPASE
A2 HOMOLOG 2)		 2j4e INOSINE TRIPHOSPHATE
PYROPHOSPHATASE
(Homo
sapiens) 		4 / 7 ASN A  16
LYS A  18
LYS A  19
LEU A  69
 ITT  A1001 (-3.9A)
None
ITT  A1001 (-2.7A)
None
 1.17A 4yv5B-2j4eA:
undetectable		 4yv5B-2j4eA:
19.61
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.
5CFS_A_TOYA203_1
(AAD(2''),GENTAMICIN
2''-NUCLEOTIDYLTRANS
FERASE,GENTAMICIN
RESISTANCE PROTEIN)		 2j4e INOSINE TRIPHOSPHATE
PYROPHOSPHATASE
(Homo
sapiens) 		4 / 8 ASP A 148
GLU A  22
ASP A 152
TYR A 164
 None
ITT  A1001 ( 4.5A)
ITT  A1001 (-3.0A)
None
 0.90A 5cfsA-2j4eA:
undetectable		 5cfsA-2j4eA:
23.61