Structure of PDB 2fdd Chain B

Receptor sequence
>2fddB (length=99) Species: 11676 (Human immunodeficiency virus 1) [Search protein sequence]
PQITLWQRPIVTIKIGGQQREALLDTGADDTVLEDINLPGRWKPKIIGGV
GGFVKVRQYDQVPIEICGHKVIGTVLVGPTPANIIGRNLMTQIGCTLNF
3D structure
PDB2fdd Ultra-potent P1 modified arylsulfonamide HIV protease inhibitors: The discovery of GW0385.
ChainB
Resolution1.58 Å
3D
structure
Catalytic site residues are labeled in the structure
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Enzymatic activity
Catalytic site (original residue number in PDB) D25 T26 G27
Catalytic site (residue number reindexed from 1) D25 T26 G27
Enzyme Commision number 3.4.23.16: HIV-1 retropepsin.
Interaction with ligand
Site
#
Ligand Ligand
chain
Binding residues on receptor
(original residue number in PDB)
Binding residues on receptor
(residue number reindexed from 1)
Binding affinity
BS01 385 B D25 G27 A28 D30 P81 A82 I84 D25 G27 A28 D30 P81 A82 I84 MOAD: ic50=4.8nM
PDBbind-CN: -logKd/Ki=8.32,IC50=4.8nM
Gene Ontology
Molecular Function
GO:0004190 aspartic-type endopeptidase activity
Biological Process
GO:0006508 proteolysis

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Molecular Function

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Biological Process
External links
PDB RCSB:2fdd, PDBe:2fdd, PDBj:2fdd
PDBsum2fdd
PubMed16458505
UniProtQ7SPG9

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