Structure of PDB 6e0h Chain B Binding Site BS02

Receptor Information
>6e0h Chain B (length=586) Species: 330879 (Aspergillus fumigatus Af293) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NHHVDYVIRFNYGDIDTPEAIKKFEVLLLELSEVGLQTEVRQLFVFVRAA
SKKKLKRAVYQSRVRDWLYGVRNTEPEPASSAKPQSEAERLLVIYHLITV
PKPRHGEWKNVDAIFPLHDEETNRQCMREWSKKTFLSTEDLDRIRNTFGE
HVGFYFAFLQSYFRFLMFPAAFGFSCWLLLGSFSIIYTVVNCLWCIVFIE
YWKRQEEDLSCRWQTKGVSAVHEKRAEFKPEKEVFPATKRMYRQLLQVPF
ALLAAVALGAIIATCFAIEIFISEVYLKGYLVFIPTILVSALIPTMSAVL
LTVATKLNDYENYETQDAYKVALTQKIFVVNFITSYLPIILTAFVYVPFA
SRIVPYLDVFHSINPDRLRKQVIYFTVTAQIVGFALETIVPFVKQRVFRE
YKEARFLTRVRNEAELEDYDVTDDLREMCIQFGYLALFSPVWPLVPVSFL
INNWVELRSDFFKICVECKRPWPQRADTIGPWLDSLGFLSWVGSITSSAL
VYMFSNGHPTTIRCWALLLTIFFSEHLYLIVRYAVRSALAKLEPPNTRRE
RIERFMMRKRYLDTVLFWMRQRGWKESAEVGLSLIT
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 chain6e0h Chain B Residue 802 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6e0h Structural basis of Ca2+-dependent activation and lipid transport by a TMEM16 scramblase.
Resolution4.05 Å
Binding residue
(original residue number in PDB)		E445 E514 E543 D547
Binding residue
(residue number reindexed from 1)		E387 E427 E456 D460
Annotation score5
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005245 voltage-gated calcium channel activity
GO:0005254 chloride channel activity
GO:0017128 phospholipid scramblase activity
Biological Process
GO:0017121 plasma membrane phospholipid scrambling
GO:0034220 monoatomic ion transmembrane transport
GO:0045332 phospholipid translocation
GO:0070588 calcium ion transmembrane transport
GO:1902476 chloride transmembrane transport
Cellular Component
GO:0016020 membrane
GO:0032541 cortical endoplasmic reticulum

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6e0h, PDBe:6e0h, PDBj:6e0h
PDBsum6e0h
PubMed30648972
UniProtQ4WA18

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