Structure of PDB 9atg Chain A

Receptor sequence
>9atgA (length=306) Species: 1335626 (Middle East respiratory syndrome-related coronavirus) [Search protein sequence]
HHSGLVKMSHPSGDVEACMVQVTCGSMTLNGLWLDNTVWCPRHVMCPADQ
LSDPNYDALLISMTNHSFSVQKHIGAPANLRVVGHAMQGTLLKLTVDVAN
PSTPAYTFTTVKPGAAFSVLACYNGRPTGTFTVVMRPNYTIKGSFLCGSC
GSVGYTKEGSVINFCYMHQMELANGTHTGSAFDGTMYGAFMDKQVHQVQL
TDKYCSVNVVAWLYAAILNGCAWFVKPNRTSVVSFNEWALANQFTEFVGT
QSVDMLAVKTGVAIEQLLYAIQQLYTGFQGKQILGSTMLEDEFTPEDVNM
QIMGVV
3D structure
PDB9atg Structure-Guided Design of Potent Coronavirus Inhibitors with a 2-Pyrrolidone Scaffold: Biochemical, Crystallographic, and Virological Studies.
ChainA
Resolution1.75 Å
3D
structure
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Interaction with ligand
Site
#		 Ligand Ligand
chain		 Binding residues on receptor
(original residue number in PDB)		 Binding residues on receptor
(residue number reindexed from 1)		 Binding affinity
BS01 A1AGT A H41 F143 G146 C148 H166 Q167 M168 E169 L170 A171 G173 D190 Q192 V193 H43 F145 G148 C150 H168 Q169 M170 E171 L172 A173 G175 D192 Q194 V195
BS02 A1AGS A H41 F143 C148 H166 Q167 M168 E169 L170 A171 Q192 V193 H43 F145 C150 H168 Q169 M170 E171 L172 A173 Q194 V195
External links
PDB RCSB:9atg, PDBe:9atg, PDBj:9atg
PDBsum9atg
PubMed38953866
UniProtK9N638|R1A_MERS1 Replicase polyprotein 1a (Gene Name=1a)

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