Structure of PDB 9eox Chain C Binding Site BS01

Receptor Information

>9eox Chain C (length=305) Species: 2697049 (Severe acute respiratory syndrome coronavirus 2) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]

SGFRKMAFPSGKVEGCMVQVTCGTTTLNGLWLDDVVYCPRHVICTSEDML
NPNYEDLLIRKSNHNFLVQAGNVQLRVIGHSMQNCVLKLKVDTANPKTPK
YKFVRIQPGQTFSVLACYNGSPSGVYQCAMRPNFTIKGSFLNGSCGSVGF
NIDYDCVSFCYMHHMELPTGVHAGTDLEGNFYGPFVDRQTAQAAGTDTTI
TVNVLAWLYAAVINGDRWFLNRFTTTLNDFNLVAMKYNYEPLTQDHVDIL
GPLSAQTGIAVLDMCASLKELLQNGMNGRTILGSALLEDEFTPFDVVRQC
SGVTF

Ligand information

>9eox Chain I (length=3) Species: 32630 (synthetic construct) [Search peptide sequence] [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

KWF

Receptor-Ligand Complex Structure

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Structure summary

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PDB	9eox Identification of novel and potent inhibitors of SARS-CoV-2 main protease from DNA-encoded chemical libraries.
Resolution	2.54 Å
Binding residue (original residue number in PDB)	F140 L141 N142 C145 H163 M165 E166 H172 D187 R188 Q189 T190
Binding residue (residue number reindexed from 1)	F140 L141 N142 C145 H163 M165 E166 H172 D187 R188 Q189 T190

External links

PDB	RCSB:9eox, PDBe:9eox, PDBj:9eox
PDBsum	9eox
PubMed	39194208
UniProt	P0DTD1\|R1AB_SARS2 Replicase polyprotein 1ab (Gene Name=rep)

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