Structure of PDB 5k8g Chain A Binding Site BS03

Receptor Information
>5k8g Chain A (length=511) Species: 178399 (Marinomonas primoryensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ATAGTVTVNAITSDDTIDGIELGQTISISGKAVGGDISVGDVVKMTINNT
EYSTTVKAGGIWMIAGVLGSDLAADSEFDVVVTSSDAAGNKVQSIGTSTH
SVDLSAEANFSLAEGQQHVLTNLPEGFGFPDGTTEVVTNFGGTITLGDDG
EYRYDAPVRDHGDAVSDKDSVTVTLEDGRTFTVNLDIQDSAPVAVDDQDS
IVVQHEEFEVSEIAASWVSYTHGESVTTFDGTSDLGGVDNDSAKDQIRWG
NPAESKQSGYGFIDNDSNLEGRFDLNQDISVGTFTHYNYPVYSGGAITSA
EMSVEFSVLDHLGVSTPVTLTVNFDHNETPNTNDVNASRDIVTVQNTHVT
FERDGDIYTVQIVGFREVGNPDGEVVTSIYTNENAATSYELVVRVVEGDG
YSLPSTEGNIFDDNGLGADSLGADGSVTVVGVAVGAIVSSNESVGHSIEG
QYGNLVLNSDGSYVYDVTASVSDIPAGATESFAYLIQDQDGSTSSANLSI
NVGTNTASTPD
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain5k8g Chain A Residue 603 [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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PDB5k8g Structure of a 1.5-MDa adhesin that binds its Antarctic bacterium to diatoms and ice.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		E116 R161 H163 D191 D426 D492
Binding residue
(residue number reindexed from 1)		E114 R159 H161 D189 D424 D490
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links