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3BVB

Cystal structure of HIV-1 Active Site Mutant D25N and inhibitor Darunavir

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 Residues6
DetailsBINDING SITE FOR RESIDUE NA A 501
ChainResidue
AASP60
AHOH1033
AHOH1085
AHOH1087
AHOH1107
AHOH1133

site_idAC2
Number of Residues22
DetailsBINDING SITE FOR RESIDUE 017 B 401
ChainResidue
AALA28
AASP29
AASP30
AGLY48
AGLY49
AILE50
APRO81
AILE84
BASN25
BGLY27
BALA28
BASP29
BASP30
BGLY48
BGLY49
BILE50
BPRO81
BILE84
BHOH1056
ALEU23
AASN25
AGLY27

site_idAC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL B 801
ChainResidue
BTRP42
BLYS55
BARG57
BHOH1138

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: For protease activity; shared with dimeric partner => ECO:0000255|PROSITE-ProRule:PRU10094
ChainResidueDetails
AASN25
BASN25

site_idSWS_FT_FI2
Number of Residues2
DetailsSITE: Cleavage; by viral protease => ECO:0000250
ChainResidueDetails
APHE99
BPHE99

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASN25
ATHR26

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
BASN25
BTHR26

site_idCSA3
Number of Residues1
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASN25

site_idCSA4
Number of Residues1
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
BASN25

222036

PDB entries from 2024-07-03

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