Structure of PDB 8s0l Chain A Binding Site BS01

Receptor Information
>8s0l Chain A (length=369) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GIECDSSGTCINPSNWCDGVSHCPGGEDENRCVRLYGPNFILQVYSSQRK
SWHPVCQDDWNENYGRAACRDMGYKNNFYSSQGIVDDSGSTSFMKLNTSA
GNVDIYKKLYHSDACSSKAVVSLRCIACGVNLNIVGGESALPGAWPWQVS
LHVQNVHVCGGSIITPEWIVTAAHCVEKPLNNPWHWTAFAGILRQSFMFY
GAGYQVEKVISHPNYDSKTKNNDIALMKLQKPLTFNDLVKPVCLPNPGMM
LQPEQLCWISGWGATEEKGKTSEVLNAAKVLLIETQRCNSRYVYDNLITP
AMICAGFLQGNVDSCQGDAGGPLVTSKNNIWWLIGDTSWGSGCAKAYRPG
VYGNVMVFTDWIYRQMRAD
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 chain8s0l Chain A Residue 602 [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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PDB8s0l TMPRSS2 is a functional receptor for human coronavirus HKU1
Resolution1.8 Å
Binding residue
(original residue number in PDB)		N131 D134 V136 H138 D144 E145
Binding residue
(residue number reindexed from 1)		N15 D18 V20 H22 D28 E29
Annotation score4
External links
PDB RCSB:8s0l, PDBe:8s0l, PDBj:8s0l
PDBsum8s0l
PubMed38964326
UniProtO15393|TMPS2_HUMAN Transmembrane protease serine 2 (Gene Name=TMPRSS2)

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