SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'HP8'


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.
1AFS_A_TESA325_1
(3-ALPHA-HYDROXYSTERO
ID DEHYDROGENASE)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		4 / 7 TYR A 346
THR A 395
ASN A 242
TYR A 214
 None
None
HP8  A 601 (-4.0A)
None
 1.40A 1afsA-3o82A:
undetectable		 1afsA-3o82A:
18.81
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.
4Z2E_H_TR6H101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		3 / 5 GLY A 338
GLY A 342
GLU A 341
 HP8  A 601 (-3.5A)
None
HP8  A 601 ( 4.8A)
 0.43A 4z2eA-3o82A:
undetectable
4z2eD-3o82A:
undetectable		 4z2eA-3o82A:
22.39
4z2eD-3o82A:
21.22
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.
5LAK_I_BEZI1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		3 / 3 SER A 418
TYR A 417
TYR A 416
 HP8  A 601 ( 4.6A)
None
None
 0.84A 5lakA-3o82A:
undetectable
5lakI-3o82A:
undetectable		 5lakA-3o82A:
19.78
5lakI-3o82A:
2.78
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.
5LAK_J_BEZJ1_0
(3CL PROTEASE
BEZ-TYR-TYR-ASN-ECC
PEPTIDE INHIBITOR)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		3 / 3 SER A 418
TYR A 417
TYR A 416
 HP8  A 601 ( 4.6A)
None
None
 0.84A 5lakC-3o82A:
undetectable
5lakJ-3o82A:
undetectable		 5lakC-3o82A:
19.78
5lakJ-3o82A:
2.78
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.
5WM2_A_SALA601_1
(SALICYLATE-AMP
LIGASE)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		6 / 9 HIS A 241
ASN A 242
PHE A 243
GLY A 314
VAL A 336
GLY A 338
 HP8  A 601 (-4.1A)
HP8  A 601 (-4.0A)
HP8  A 601 (-4.0A)
HP8  A 601 (-3.5A)
HP8  A 601 (-4.8A)
HP8  A 601 (-3.5A)
 0.38A 5wm2A-3o82A:
56.7		 5wm2A-3o82A:
8.67
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.
5XXI_A_LSNA503_1
(CYTOCHROME P450 2C9)		 3o82 PEPTIDE ARYLATION
ENZYME
(Acinetobacter
baumannii) 		5 / 12 ILE A 275
PHE A 243
LEU A 333
PRO A 326
LEU A 307
 None
HP8  A 601 (-4.0A)
None
None
None
 1.22A 5xxiA-3o82A:
undetectable		 5xxiA-3o82A:
22.45