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5JG1

HIV-1 wild Type protease with GRL-031-14A (a Adamantane P1-Ligand with tetrahydropyrano-tetrahydrofuran in P2 and isobutylamine in P1')

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
AHOH618
AHOH635
AHOH637
AHOH638
AHOH664

site_idAC2
Number of Residues4
Detailsbinding site for residue CL A 502
ChainResidue
BARG41
ATHR74
AASN88
AHOH673

site_idAC3
Number of Residues6
Detailsbinding site for residue GOL A 503
ChainResidue
ALEU5
AHOH606
BTHR91
BALA95
BTHR96
BHOH336

site_idAC4
Number of Residues17
Detailsbinding site for residue 6KR B 201
ChainResidue
AARG8
AASP25
AGLY27
AALA28
AASP30
AGLY48
AGLY49
AVAL82
AILE84
BASP25
BGLY27
BALA28
BASP29
BASP30
BGLY48
BILE50
BHOH342

site_idAC5
Number of Residues4
Detailsbinding site for residue NA B 202
ChainResidue
BASP60
BHOH325
BHOH345
BHOH370

site_idAC6
Number of Residues6
Detailsbinding site for residue NA B 203
ChainResidue
BHOH310
BHOH326
BHOH329
BHOH341
BHOH389
BHOH404

site_idAC7
Number of Residues1
Detailsbinding site for residue CL B 204
ChainResidue
BTRP6

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, ECO:0000269|PubMed:12924029
ChainResidueDetails
AASP25
BASP25

site_idSWS_FT_FI2
Number of Residues2
DetailsSITE: Cleavage; by viral protease => ECO:0000269|PubMed:2476069
ChainResidueDetails
APHE99
BPHE99

219140

PDB entries from 2024-05-01

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