Structure of PDB 3p4g Chain B Binding Site BS01

Receptor Information
>3p4g Chain B (length=313) Species: 178399 (Marinomonas primoryensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SFGFWDGTSTQAEITHSFDHYIGSAFDASNNNVAVTGNVSATLNVLAGDD
KVSIDGNVEDVLVAANVAVLDMGTGNDQLYVAGDVLGKIDAGTGNDEIYI
KGDVSAAVDAGTGNDEVYIGGNLSGDLDAGTDNDNIQIGGDVNAALNAGT
GNDNLIIGHDVSGIVNMGTDNDTVEVGRTINASGKVLLDTGDDSLLVSGD
LFGEVDGGTGNDTIIIAGKVSGNIQGGTGNDIVRVQSQVWAEANISLGTG
DDVLIVEHELHGTVAGNEGDDSIYLKFYTKEQYNNNSDLRNRVANFEHIR
VSDGVVKGSPADF
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 chain3p4g Chain B Residue 401 [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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PDB3p4g Anchored clathrate waters bind antifreeze proteins to ice.
Resolution1.7 Å
Binding residue
(original residue number in PDB)		D34 S36 N38 V52 L53 A54 D57
Binding residue
(residue number reindexed from 1)		D27 S29 N31 V45 L46 A47 D50
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links