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6YWK

Crystal structure of SARS-CoV-2 (Covid-19) NSP3 macrodomain in complex with HEPES

Entity
Entity IDChain IDDescriptionTypeChain lengthFormula weightNumber of moleculesDB Name (Accession)Biological sourceDescriptive keywords
1A, B, C, D, E
(A, B, C, D, E)
NSP3 macrodomainpolymer17318676.45UniProt (P0DTD1)
Pfam (PF01661)
Severe acute respiratory syndrome coronavirus 2 (2019-nCoV)pp1ab,ORF1ab polyprotein
2AA, EA, F, FA, G...
(D, E, A, C)
1,2-ETHANEDIOLnon-polymer62.122Chemie (EDO)
3BA, I
(E, C)
MAGNESIUM IONnon-polymer24.32Chemie (MG)
4CA, DA, J
(E, C)
4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACIDnon-polymer238.33Chemie (EPE)
5GA, HA, IA, JA, KA
(A, B, C, D, E)
waterwater18.0304Chemie (HOH)
Sequence modifications
A, B, C, D, E: 3 - 172 (UniProt: P0DTD1)
PDBExternal DatabaseDetails
Gly 0-expression tag
His 1-expression tag
Met 2-expression tag
Sequence viewer
Contents of the asymmetric unit
PolymersNumber of chains5
Total formula weight93381.9
Non-Polymers*Number of molecules27
Total formula weight2129.0
All*Total formula weight95510.9
*Water molecules are not included.

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PDB entries from 2025-06-11

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