- PDB-2w2b: Crystal Structure of single point mutant Tyr20Phe p-coumaric Acid... -
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Basic information
Entry
Database: PDB / ID: 2w2b
Title
Crystal Structure of single point mutant Tyr20Phe p-coumaric Acid Decarboxylase from Lactobacillus plantarum: structural insights into the active site and decarboxylation catalytic mechanism
Components
P-COUMARIC ACID DECARBOXYLASE
Keywords
LYASE / ACTIVE SITE / COUMARIC ACIDS / DECARBOXYLATION / CATALYTIC MECHANISM
Resolution: 1.4→58.22 Å / Cor.coef. Fo:Fc: 0.952 / Cor.coef. Fo:Fc free: 0.938 / SU B: 1.99 / SU ML: 0.042 / Cross valid method: THROUGHOUT / ESU R: 0.071 / ESU R Free: 0.071 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.221
3875
5 %
RANDOM
Rwork
0.199
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obs
0.2
72949
91.5 %
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Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK