Structure of PDB 4e5t Chain C Binding Site BS01

Receptor Information
>4e5t Chain C (length=386) Species: 244592 (Roseibium alexandrii DFL-11) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MRLSDIETFVVGNPPPRHGGRYFIFVKLVTACGITGYGEIYNATFGPDLV
AKMAEDVFARQFAGEDPHHIEKLWHKTYGAGYTQRPDVTVMGVLSGLEMA
CWDIIGKAAGKPAYELLGGKVHERLRSYTYLYPPNVYNDADMAAEAAAKA
VDQGFTAVKFDPAGAYTIYDGHQPSLEDLERSEAFCKQIRAAVGTKADLL
FGTHGQFTVSGAKRLARRLEAYDPLWFEEPIPPEKPEDMAEVARYTSIPV
ATGERLCTKYEFSRVLETGAASILQMNLGRVGGLLEAKKIAAMAECHSAQ
IAPHLYCGPLVALANIQLATCSPNFLVLESIRTFDGFFAELLTTPIRWEN
GYIIPSQEPGLGHDLNEDVARANPYTGSDLHLGFQE
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain4e5t Chain C Residue 501 [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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PDB4e5t Crystal structure of a putative MR/ML enzyme from Labrenzia alexandrii DFL-11
Resolution2.9 Å
Binding residue
(original residue number in PDB)		E239 E265
Binding residue
(residue number reindexed from 1)		E228 E254
Annotation score4
External links