Structure of PDB 5m41 Chain A Binding Site BS01

Receptor Information
>5m41 Chain A (length=712) Species: 28173 (Vibrio nigripulchritudo) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LGGINHSAVANRYRNLTKEAQQNLYQFAIIEVLSQIREERPDKNLDAYNA
LIGKVTTVDIYTYGATNMFFMPDARGSKTGILVNLNSPDKPYTNIQQPSD
FNNINDESFRQNFTSWEKRDGTGWNLGYFNQKTPRTINISELSKILVERL
DYHVSQENNDDQILSTLLLDVLPRSAKGAAREPLGVSASGIPFQLEFTFE
GFTSPTDELRAIQSPFSHLAKYFDLLVASTNGVEYSQEQAENIGAWIDSG
TQLLMSASGIGAAVSVIQGAAGLTADAIEGKEIDPLDVISLSLAAIPGGK
IVAKLSKVSKNLGQVVRGGISIAETGVDIVGSSRDLIEGFKKGNFTDIIN
GLVSVASSSASGRPGKSKIGNAIKKGNPDAPLPTRPTYRNHEGEVRPIPT
AQTKSFFERVAIVRREGLSGRGAIGLDLTAAQKRGAELSGMGGTISKSNP
NGNVSQVYINEAEGIEKNITYRKVPVPNEPGNFENRLQESFLDNNGQTKW
RDFPYAGEEFDFRLQHKDDFNNIGDLGVGKQGIIAVNNPYSFVHHSHTFE
QKGISNNHLTLESNAFLTYIEGKKTGDFENKYGNEMEWLVRKFKTKKNDF
DLKDIPDNIHFRTDREKGDHSLTTYTLQDFITVVENAPTKMRKVKNDEFA
LNNIVESMRATAKNMGASPDTLFLDVASTNYMTQLMGQVLTNGRQELNLQ
GLSNAAQKLRNG
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 chain5m41 Chain A Residue 801 [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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PDB5m41 Nigritoxin is a bacterial toxin for crustaceans and insects.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		V189 S190 E192 D195
Binding residue
(residue number reindexed from 1)		V154 S155 E157 D160
Annotation score4
External links