Structure of PDB 6bxj Chain A Binding Site BS01

Receptor Information

>6bxj Chain A (length=619) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

GPNICTTRGVSSCQQCLAVSPMCAWCSDEALPLGSPRCDLKENLLKDNCA
PESIEFPVSEARVLEDRPLSDKGSGDSSQVTQVSPQRIALRLRPDDSKNF
SIQVRQVEDGNVDLVFLFDGSMSLQPDEFQKILDFMKDVMKKLSNTSYQF
AAVQFSTSYKTEFDFSDYVKWKDPDALLKHVKHMLLLTNTFGAINYVATE
VFREELGARPDATKVLIIITDGEATDSGNIDAAKDIIRYIIGIGKHFQTK
ESQETLHKFASKPASEFVKILDTFEKLKDLFTELQKKIRSKVELEVRDLP
EELSLSFNATCLNNEVIPGLKSCMGLKIGDTVSFSIEAKVRGCPQEKEKS
FTIKPVGFKDSLIVQVTFDCDCACQAQAEPNSHRCNNGNGTFECGVCRCG
PGWLGSQCECSEEQDECSPREGQPVCSQRGECLCGQCVCHSSDFGKITGK
YCECDDFSCVRYKGEMCSGHGQCSCGDCLCDSDWTGYYCNCTTRTDTCMS
SNGLLCSGRGKCECGSCVCIQPGSYGDTCEKCPTCPDACTFKKECVECKK
FDRGALHDENTCNRYCRDEIESVKELKDTGKDAVNCTYKNEDDCVVRFQY
YEDSSGKSILYVVEEPECP

Ligand information

Ligand ID

InChI

InChI=1S/Mg/q+2

InChIKey

JLVVSXFLKOJNIY-UHFFFAOYSA-N

SMILES

Software	SMILES
ACDLabs 10.04 OpenEye OEToolkits 1.5.0	[Mg+2]
CACTVS 3.341	[Mg++]

Formula

Name

MAGNESIUM ION

PDB chain

6bxj Chain A Residue 701 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure

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Structure summary

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PDB	6bxj Autonomous conformational regulation of beta3integrin and the conformation-dependent property of HPA-1a alloantibodies.
Resolution	2.092 Å
Binding residue (original residue number in PDB)	S121 S123 D221
Binding residue (residue number reindexed from 1)	S121 S123 D221
Annotation score	4

Enzymatic activity

Enzyme Commision number

External links

PDB	RCSB:6bxj, PDBe:6bxj, PDBj:6bxj
PDBsum	6bxj
PubMed	30209215
UniProt	P05106\|ITB3_HUMAN Integrin beta-3 (Gene Name=ITGB3); P20701\|ITAL_HUMAN Integrin alpha-L (Gene Name=ITGAL)

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