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1OEX

Atomic Resolution Structure of Endothiapepsin in Complex with a Hydroxyethylene Transition State Analogue Inhibitor H261

Functional Information from GO Data
ChainGOidnamespacecontents
A0004190molecular_functionaspartic-type endopeptidase activity
A0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 410
ChainResidue
ACYS254
AASP278
AGLY280
APRO281
ACYS289

site_idAC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 500
ChainResidue
AHOH2473
AHOH2474
AHOH2475
ATYR178
ASER181
AILE182
AHOH2329

site_idAC3
Number of Residues10
DetailsBINDING SITE FOR RESIDUE SO4 A 501
ChainResidue
ASER112
ASER113
ATHR321
AHOH2180
AHOH2221
AHOH2476
AHOH2477
AHOH2478
AHOH2479
AHOH2480

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE SO4 A 502
ChainResidue
ASER136
APRO137
AHOH2481
AHOH2483
AHOH2484

site_idAC5
Number of Residues8
DetailsBINDING SITE FOR RESIDUE SO4 A 503
ChainResidue
AALA268
AARG269
ASER283
AHOH2331
AHOH2416
AHOH2437
AHOH2467
AHOH2485

site_idAC6
Number of Residues35
DetailsBINDING SITE FOR CHAIN B OF INHIBITOR H261
ChainResidue
ALEU13
AASP15
AASP33
AASP35
AGLY37
ASER77
ATYR78
AGLY79
AASP80
ASER82
AASP118
AILE121
ALEU132
APHE193
AASP218
AGLY220
ATHR221
ATHR222
APHE279
AGLY280
APRO281
AILE282
AHOH2170
BHOH2002
BHOH2003
BHOH2004
BHOH2005
BHOH2006
BHOH2008
BHOH2009
BHOH2010
BHOH2011
BHOH2012
BHOH2013
BHOH2014

Functional Information from PROSITE/UniProt
site_idPS00141
Number of Residues12
DetailsASP_PROTEASE Eukaryotic and viral aspartyl proteases active site. LDFDTGSSDLWV
ChainResidueDetails
ALEU32-VAL43
AILE216-PRO227

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsActive site: {}
ChainResidueDetails

Catalytic Information from CSA
site_idCSA1
Number of Residues1
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
AASP35

site_idCSA2
Number of Residues1
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
AASP218

site_idCSA3
Number of Residues4
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
ATHR221
ASER38
AASP35
AASP218

site_idCSA4
Number of Residues4
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
AASP35
AASP218
ATHR219
ATHR36

site_idCSA5
Number of Residues3
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
ASER38
AASP35
AASP218

site_idCSA6
Number of Residues4
DetailsAnnotated By Reference To The Literature 1am5
ChainResidueDetails
ATHR221
AASP35
AASP218
ATHR36

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PDB entries from 2025-12-17

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