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1HIH

COMPARATIVE ANALYSIS OF THE X-RAY STRUCTURES OF HIV-1 AND HIV-2 PROTEASES IN COMPLEX WITH CGP 53820, A NOVEL PSEUDOSYMMETRIC 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 Residues2
DetailsBINDING SITE FOR RESIDUE BME A 100
ChainResidue
APRO1
ACYS67

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE BME B 100
ChainResidue
BPRO1
BCYS67

site_idAC3
Number of Residues19
DetailsBINDING SITE FOR RESIDUE C20 B 101
ChainResidue
AASP25
AGLY27
AALA28
AASP29
AGLY48
AGLY49
APRO81
AVAL82
BARG8
BASP25
BGLY27
BALA28
BASP29
BGLY48
BGLY49
BILE50
BVAL82
BILE84
BHOH104

site_idCAT
Number of Residues2
Details
ChainResidue
AASP25
BASP25

site_idS1
Number of Residues9
Details
ChainResidue
ALEU23
ATHR80
APRO81
AVAL82
AILE84
BGLY27
BGLY49
BILE50
AARG8

site_idS1P
Number of Residues9
Details
ChainResidue
AGLY27
AGLY49
AILE50
BARG8
BLEU23
BTHR80
BPRO81
BVAL82
BILE84

site_idS2
Number of Residues6
Details
ChainResidue
AILE50
BALA28
BASP30
BVAL32
BILE47
BILE84

site_idS2P
Number of Residues6
Details
ChainResidue
AALA28
AASP30
AVAL32
AILE47
AILE84
BILE50

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
DetailsSITE: Cleavage; by viral protease => ECO:0000250
ChainResidueDetails
AILE64
BILE64

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: Phosphotyrosine; by host => ECO:0000250
ChainResidueDetails
AILE64
BILE64

Catalytic Information from CSA
site_idCSA1
Number of Residues4
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASP25
ATHR26
BASP25
BTHR26

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a30
ChainResidueDetails
AASP25
BASP25

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PDB entries from 2024-07-17

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