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3QIH

HIV-1 protease (mutant Q7K L33I L63I) in complex with a novel inhibitor

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 Residues10
DetailsBINDING SITE FOR RESIDUE FG7 A 100
ChainResidue
AARG8
BHOH191
ALEU23
AASP25
APRO81
AVAL82
AILE84
BGLY27
BGLY49
BNI7100

site_idAC2
Number of Residues5
DetailsBINDING SITE FOR RESIDUE CL A 101
ChainResidue
ATHR74
AASN88
AHOH198
AHOH257
BARG41

site_idAC3
Number of Residues21
DetailsBINDING SITE FOR RESIDUE NI7 B 100
ChainResidue
AASP25
AGLY27
AALA28
AASP29
AASP30
AVAL32
AGLY49
AILE50
AILE84
AFG7100
BASP25
BALA28
BASP29
BASP30
BVAL32
BGLY49
BILE50
BFG7101
BHOH176
BHOH178
BHOH353

site_idAC4
Number of Residues10
DetailsBINDING SITE FOR RESIDUE FG7 B 101
ChainResidue
ATRP6
AGLY27
AGLY48
AGLY49
BARG8
BLEU23
BASP25
BPRO81
BILE84
BNI7100

site_idAC5
Number of Residues4
DetailsBINDING SITE FOR RESIDUE CL B 102
ChainResidue
BTHR74
BASN88
BHOH115
BHOH185

site_idAC6
Number of Residues1
DetailsBINDING SITE FOR RESIDUE CL B 103
ChainResidue
BTRP6

site_idAC7
Number of Residues5
DetailsBINDING SITE FOR RESIDUE PGE B 104
ChainResidue
ATRP42
AARG57
BLEU19
BGLU21
BHOH138

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

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
AASP25
BASP25

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

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PDB entries from 2024-07-24

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