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2PWR

HIV-1 protease in complex with a carbamoyl decorated pyrrolidine-based 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 Residues3
DetailsBINDING SITE FOR RESIDUE CL B 701
ChainResidue
BTHR74
BASN88
BHOH769

site_idAC2
Number of Residues4
DetailsBINDING SITE FOR RESIDUE CL A 702
ChainResidue
ATHR74
AASN88
AHOH730
BARG41

site_idAC3
Number of Residues2
DetailsBINDING SITE FOR RESIDUE CL B 703
ChainResidue
BTRP6
BLYS55

site_idAC4
Number of Residues24
DetailsBINDING SITE FOR RESIDUE G4G B 501
ChainResidue
AASP25
AGLY27
AALA28
AASP29
AASP30
AGLY48
AILE50
AILE84
AHOH762
BLEU23
BASP25
BGLY27
BALA28
BASP29
BASP30
BILE47
BGLY48
BGLY49
BILE50
BPRO81
BILE84
BHOH706
BHOH768
BHOH801

site_idAC5
Number of Residues9
DetailsBINDING SITE FOR RESIDUE GOL B 601
ChainResidue
AGLN18
AMET36
ASER37
BTHR12
BILE13
BGLU65
BCYS67
BGLY68
BHOH800

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. ALLDTGADDTVL
ChainResidueDetails
AALA22-LEU33

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

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASP25
ATHR26

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
BASP25
BTHR26

site_idCSA3
Number of Residues1
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASP25

site_idCSA4
Number of Residues1
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
BASP25

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PDB entries from 2024-07-17

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