Structure of PDB 4j69 Chain A Binding Site BS02

Receptor Information
>4j69 Chain A (length=124) Species: 9913 (Bos taurus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KETAAAKFERQHMDSSTSAASSSNYCNQMMKSRNLTKDRCKPVNTFVHES
LADVQAVCSQKNVACKNGQTNCYQSYSTMSITDCRETGSSKYPNCAYKTT
QANKHIIVACEGNPYVPVHFDASV
Ligand information
Ligand IDRSG
InChIInChI=1S/C6H10O3/c7-5-3-9-6-4(5)1-2-8-6/h4-7H,1-3H2/t4-,5-,6+/m1/s1
InChIKeyRCDXYCHYMULCDZ-PBXRRBTRSA-N
SMILES
SoftwareSMILES
CACTVS 3.370O[CH]1CO[CH]2OCC[CH]12
OpenEye OEToolkits 1.7.2C1COC2C1C(CO2)O
CACTVS 3.370O[C@@H]1CO[C@@H]2OCC[C@H]12
OpenEye OEToolkits 1.7.2C1CO[C@@H]2[C@H]1[C@@H](CO2)O
ACDLabs 12.01OC1COC2OCCC12
FormulaC6 H10 O3
Name(3S,3aR,6aS)-hexahydrofuro[2,3-b]furan-3-ol
ChEMBL
DrugBank
ZINCZINC000022012705
PDB chain4j69 Chain A Residue 205 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB4j69 DRoP: A program for analysis of water structure on protein surfaces
Resolution1.892 Å
Binding residue
(original residue number in PDB)		A20 S22
Binding residue
(residue number reindexed from 1)		A20 S22
Annotation score1
Enzymatic activity
Catalytic site (original residue number in PDB) H12 K41 H119 F120 D121
Catalytic site (residue number reindexed from 1) H12 K41 H119 F120 D121
Enzyme Commision number 4.6.1.18: pancreatic ribonuclease.
Gene Ontology
Molecular Function
GO:0003676 nucleic acid binding
GO:0004519 endonuclease activity
GO:0004522 ribonuclease A activity
GO:0004540 RNA nuclease activity
GO:0005515 protein binding
GO:0016829 lyase activity
Biological Process
GO:0050830 defense response to Gram-positive bacterium
Cellular Component
GO:0005576 extracellular region

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:4j69, PDBe:4j69, PDBj:4j69
PDBsum4j69
PubMed
UniProtP61823|RNAS1_BOVIN Ribonuclease pancreatic (Gene Name=RNASE1)

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