Structure of PDB 1s2k Chain A Binding Site BS02

Receptor Information
>1s2k Chain A (length=199) Species: 5539 (Scytalidium lignicola) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TVESNWGGAILIGSDFDTVSATANVPSASGGSSAAGTAWVGIDGDTCQTA
ILQTGFDWYGDGTYDAWYEWEVSITISEGDSIQMSVTATSDTSGSATLEN
LTTGQKVSKSFSNESSGSLCRTNAEFIIEDFEECNSNGSDCEFVPFASFS
PAVEFTDCSVTSDGESVSLDDAQITQVIINNQDVTDCSVSGTTVSCSYV
Ligand information
Ligand IDTYR
InChIInChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
InChIKeyOUYCCCASQSFEME-QMMMGPOBSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(N)Cc1ccc(O)cc1
OpenEye OEToolkits 1.5.0c1cc(ccc1C[C@@H](C(=O)O)N)O
OpenEye OEToolkits 1.5.0c1cc(ccc1CC(C(=O)O)N)O
CACTVS 3.341N[CH](Cc1ccc(O)cc1)C(O)=O
CACTVS 3.341N[C@@H](Cc1ccc(O)cc1)C(O)=O
FormulaC9 H11 N O3
NameTYROSINE
ChEMBLCHEMBL925
DrugBankDB00135
ZINCZINC000000266964
PDB chain1s2k Chain A Residue 1001 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB1s2k The molecular structure and catalytic mechanism of a novel carboxyl peptidase from Scytalidium lignicolum
Resolution2.0 Å
Binding residue
(original residue number in PDB)		N5 W6
Binding residue
(residue number reindexed from 1)		N5 W6
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) Q53 E136
Catalytic site (residue number reindexed from 1) Q53 E129
Enzyme Commision number 3.4.23.32: scytalidopepsin B.
Gene Ontology
Molecular Function
GO:0070007 glutamic-type endopeptidase activity
Biological Process
GO:0006508 proteolysis

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Molecular Function
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Biological Process
External links
PDB RCSB:1s2k, PDBe:1s2k, PDBj:1s2k
PDBsum1s2k
PubMed14993599
UniProtP15369|PRTB_SCYLI Scytalidopepsin B

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