Structure of PDB 8wxw Chain A Binding Site BS02

Receptor Information
>8wxw Chain A (length=1078) Species: 36329 (Plasmodium falciparum 3D7) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MEWIHEKSPKHNSYDIIEKRYNEEFKMTYTVYQHKKAKTQVISLGTNDPL
DVEQAFAFYVKTLTHSGKGIPHILQHSVLSGSKNYNYKNSIGLLEKGTLH
THLNAYTFNDRTVYMAGSMNNKDFFNIMGVYMDSVFQPNVLENKYIFETE
GWTYEVEKLKEDEKGKAEIPQMKDYKVSFNGIVYNEMKGALSSPLEDLYH
EEMKYMFPDNVHSNNSGGDPKEITNLTYEEFKEFYYKNYNPKKVKVFFFS
KNNPTELLNFVDQYLGQLDYSKYRDDAVESVEYQTYKKGPFYIKKKYGDH
SEEKENLVSVAWLLNPKVSDLSLENPTDYFVLLIINNLLIHTPESVLYKA
LTDCGLGNNVIDRGLNDSLVQYIFSIGLKGIKRNNEKIKNFDKVHYEVED
VIMNALKKVVKEGFNKSAVEASINNIEFILKEANLKTSKSIDFVFEMTSK
LNYNRDPLLIFEFEKYLNIVKNKIKNEPMYLEKFVEKHFINNAHRSVILL
EGDENYAQEQENLEKQELKKRIENFNEQEKEQVIKNFEELSKYKNAEESP
EHLNKFPIISISDLNKKTLEVPVNVYFTNINENNNIMETYNKLKTNEHML
KDNMDVFLKKYVLKNTKYEGNVPILVYEMPTTGIVYLQFVFSLDHLTVDE
LAYLNLFKTLILENKTNKRSSEDFVILREKNIGSMSANVALYSKDDHLNV
TDKYNAQALFNLEMHVLSHKCNDALNIALEAVKESDFSNKKKVIDILKRK
INGMKTTFSEKGYAILMKYVKAHLNSKHYAHNIIYGYENYLKLQEQLELA
ENDFKTLENILVRIRNKIFNKKNLMVSVTSDYGALKHLFVNSNESLKNLV
SYFEENDKYINVMGWNEEIKSKKLFDEEKVKKEFFVLPTFVNSVSMSGIL
FKPGEYLDPSFTVIVAALKNSYLWDTVRGLNGAYGVFADIEYDGSVVFLS
ARDPNLEKTLATFRESAKGLRKMADTMTENDLLRYIINTIGTIDKPRRGI
ELSKLSFLRLISNESEQDRVEFRKRIMNTKKEDFYKFADLLESKVNEFEK
NIVIITTKEKANEYIANVDGEFKKVLIE
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain8wxw Chain A Residue 1206 [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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PDB8wxw Falcilysin in complex with hemoglobin alpha chain peptide
Resolution1.86 Å
Binding residue
(original residue number in PDB)		H129 H133 E243
Binding residue
(residue number reindexed from 1)		H72 H76 E186
Annotation score4
External links
PDB RCSB:8wxw, PDBe:8wxw, PDBj:8wxw
PDBsum8wxw
PubMed
UniProtQ76NL8|FCLN_PLAF7 Falcilysin (Gene Name=FLN)

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