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6B4N

a hydroxymethyl functionality at the 4-position of the 2-phenyloxazole moiety of HIV-1 protease inhibitors involving the P2' ligands

Functional Information from GO Data
ChainGOidnamespacecontents
A0004190molecular_functionaspartic-type endopeptidase activity
A0006508biological_processproteolysis
B0004190molecular_functionaspartic-type endopeptidase activity
B0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues22
Detailsbinding site for residue G53 A 201
ChainResidue
AASP25
APRO81
AVAL82
AILE84
AHOH317
BASP25
BGLY27
BALA28
BASP29
BASP30
BGLY48
AGLY27
BGLY49
BILE50
BVAL82
AALA28
AASP29
AASP30
ALYS45
AILE47
AGLY48
AGLY49

site_idAC2
Number of Residues6
Detailsbinding site for residue NA A 202
ChainResidue
AASP60
AHOH324
AHOH341
AHOH344
AHOH355
AHOH375

site_idAC3
Number of Residues4
Detailsbinding site for residue CL A 203
ChainResidue
ATHR74
AASN88
AHOH396
BARG41

site_idAC4
Number of Residues4
Detailsbinding site for residue NA B 101
ChainResidue
BHOH202
BHOH209
BHOH224
BHOH232

site_idAC5
Number of Residues1
Detailsbinding site for residue CL B 102
ChainResidue
BTRP6

site_idAC6
Number of Residues3
Detailsbinding site for residue CL B 103
ChainResidue
BTHR74
BASN88
BHOH246

site_idAC7
Number of Residues2
Detailsbinding site for residue CL B 104
ChainResidue
BVAL11
BTHR12

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ALLDTGADDTVI
ChainResidueDetails
AALA22-ILE33

222624

PDB entries from 2024-07-17

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