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6VOE

HIV-1 wild type protease with GRL-019-17A, a tricyclic cyclohexane fused tetrahydrofuranofuran (CHf-THF) derivative as the P2 ligand and a aminobenzothiazole(Abt)-based P2'-ligand

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
AHOH621
AHOH628
AHOH633
AHOH645
AHOH662

site_idAC2
Number of Residues3
Detailsbinding site for residue CL A 502
ChainResidue
ATHR74
AASN88
BARG41

site_idAC3
Number of Residues4
Detailsbinding site for residue ACT A 503
ChainResidue
AHOH681
BTRP42
BLYS55
BHOH381

site_idAC4
Number of Residues29
Detailsbinding site for residue T2R B 201
ChainResidue
AASP25
AGLY27
AALA28
AASP29
AASP30
AILE47
AGLY48
AGLY49
AILE50
APRO81
AVAL82
AILE84
AHOH638
AHOH650
BASP25
BGLY27
BALA28
BASP29
BASP30
BILE47
BGLY48
BGLY49
BILE50
BPRO81
BVAL82
BILE84
BHOH303
BHOH324
BHOH369

site_idAC5
Number of Residues1
Detailsbinding site for residue CL B 202
ChainResidue
BTRP6

site_idAC6
Number of Residues6
Detailsbinding site for residue ACT B 203
ChainResidue
BPRO39
BARG41
BTYR59
BASP60
BHOH309
BHOH383

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

222624

PDB entries from 2024-07-17

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