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PDBsum entry 7n8c

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Hydrolase PDB id
7n8c

 

 

 

 

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Contents
Protein chain
306 a.a.
Ligands
YD1
DOD ×99
PDB id:
7n8c
Name: Hydrolase
Title: Joint x-ray/neutron structure of sars-cov-2 main protease (mpro) in complex with mcule5948770040
Structure: 3c-like proteinase. Chain: a. Synonym: 3cl-pro,3clp,main protease,mpro,non-structural protein 5, nsp5,sars coronavirus main proteinase. Engineered: yes
Source: Severe acute respiratory syndrome coronavirus 2. 2019-ncov, sars-cov-2. Organism_taxid: 2697049. Gene: rep, 1a-1b. Expressed in: escherichia coli. Expression_system_taxid: 562
Resolution:
2.20Å     R-factor:   0.177     R-free:   0.192
Authors: A.Kovalevsky,D.W.Kneller,L.Coates
Key ref: d.w.kneller et al. (2021). Structural, Electronic, and Electrostatic Determinants for Inhibitor Binding to Subsites S1 and S2 in SARS-CoV-2 Main Protease. J.Med.Chem., 0, . PubMed id: 34705466
Date:
14-Jun-21     Release date:   23-Jun-21    
PROCHECK
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 Headers
 References

Protein chain
P0DTD1  (R1AB_SARS2) - 
Key:    Secondary structure

 Enzyme reactions 
   Enzyme class: E.C.3.4.22.69  - Sars coronavirus main proteinase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]

 

 
J.Med.Chem. 0: (2021)
PubMed id: 34705466  
 
 
Structural, Electronic, and Electrostatic Determinants for Inhibitor Binding to Subsites S1 and S2 in SARS-CoV-2 Main Protease.
d.w.kneller, h.li, s.galanie, g.phillips, k.l.weiss, q.zham.arnould, m.s.head, l.coates, p.v.bonnesen, a.kovalevsky.
 
  ABSTRACT  
 
No abstract given.

 

 

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