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Ligands
Code Name Style Show Link
EPE 4-(2-hydroxyethyl)-1-piperazine ethanesulfonic acid
0KU N-(4-chlorophenyl)-N'-{(S)-[5-(hydroxymethyl)-4-methyl-1,3-thiazol-2-yl][(2s)-piperidin-2-yl]methyl}ethanediamide
Non-standard Residues
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Glycosylation
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NAG 2-acetamido-2-deoxy-beta-D-glucopyranose
Modification
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Code : 4DKU   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Crystal structure of clade A/E 93TH057 HIV-1 gp120 core in complex with NBD-09027
Release Data : 2013-03-20
Compound :
mol_id molecule chains
1 HIV-1 gp120 core A,B
fragment: Chimera residue 44-492
mutation: V1V2 and V3 deletion, H375S
Source :
mol_id organism_scientific expression_system
1 Human immunodeficiency virus 1  (taxid:11676) Homo sapiens  (taxid:9606)
strain: clade A/E 93TH057
gene: env
expression_system_common: Human
expression_system_cell_line: HEK293F
expression_system_vector_type: plasmid
expression_system_plasmid: pVRC8400
Authors : Kwon, Y.D., Debnath, A.K., Kwong, P.D.
Keywords : HIV-1 gp120, clade A/E, CD4 mimic, NBD-09027, HYDROLASE
Exp. method : X-RAY DIFFRACTION ( 2.4902 Å )
Citation :

Binding mode characterization of NBD series CD4-mimetic HIV-1 entry inhibitors by X-ray structure and resistance study.

Curreli, F.,Kwon, Y.D.,Zhang, H.  et al.
(2014)  Antimicrob. Agents Chemother.  58 : 5478 - 5491

PubMed: 25001301
DOI: 10.1128/AAC.03339-14

Chain : A, B
UniProt : Q0ED31 (Q0ED31_9HIV1)
Reaction : -