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PDB: 4 results

3PVK
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BU of 3pvk by Molmil
Secreted aspartic protease 2 in complex with benzamidine
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, BENZAMIDINE, Candidapepsin-2, ...
Authors:Koester, H, Heine, A, Klebe, G.
Deposit date:2010-12-07
Release date:2011-12-07
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.27 Å)
Cite:Experimental and computational active site mapping as a starting point to fragment-based lead discovery.
Chemmedchem, 7, 2012
3Q70
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BU of 3q70 by Molmil
Secreted aspartic protease in complex with ritonavir
Descriptor: (4R)-2-METHYLPENTANE-2,4-DIOL, Candidapepsin-2, RITONAVIR, ...
Authors:Koester, H, Heine, A, Klebe, G.
Deposit date:2011-01-04
Release date:2012-01-04
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.4 Å)
Cite:The bindingmode of HIV-1 protease inhibitors to pepsin-like aspartic proteinases
To be Published
1EAG
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BU of 1eag by Molmil
Secreted aspartic proteinase (SAP2) from Candida albicans complexed with A70450
Descriptor: ASPARTIC PROTEINASE (SAP2 GENE PRODUCT), N-ethyl-N-[(4-methylpiperazin-1-yl)carbonyl]-D-phenylalanyl-N-[(1S,2S,4R)-4-(butylcarbamoyl)-1-(cyclohexylmethyl)-2-hydroxy-5-methylhexyl]-L-norleucinamide
Authors:Cutfield, J.F, Cutfield, S.M.
Deposit date:1996-05-31
Release date:1996-12-23
Last modified:2012-01-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The crystal structure of a major secreted aspartic proteinase from Candida albicans in complexes with two inhibitors.
Structure, 3, 1995
1ZAP
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BU of 1zap by Molmil
SECRETED ASPARTIC PROTEASE FROM C. ALBICANS
Descriptor: N-ethyl-N-[(4-methylpiperazin-1-yl)carbonyl]-D-phenylalanyl-N-[(1S,2S,4R)-4-(butylcarbamoyl)-1-(cyclohexylmethyl)-2-hydroxy-5-methylhexyl]-L-norleucinamide, SECRETED ASPARTIC PROTEINASE, ZINC ION
Authors:Abad-Zapatero, C, Muchmore, S.W.
Deposit date:1996-01-16
Release date:1997-04-21
Last modified:2012-01-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Structure of a secreted aspartic protease from C. albicans complexed with a potent inhibitor: implications for the design of antifungal agents.
Protein Sci., 5, 1996

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