Mass: 18.015 Da / Num. of mol.: 175 / Source method: isolated from a natural source / Formula: H2O
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Experimental details
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Experiment
Experiment
Method: X-RAY DIFFRACTION
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Sample preparation
Crystal
Density Matthews: 1.65 Å3/Da / Density % sol: 25.5 %
Crystal grow
Temperature: 293 K / Method: vapor diffusion, hanging drop Details: The reservoir for type II crystals was 1.0 M sodium citrate and 0.1 M Tris at pH 8.5 and the protein used was at 6.3 mg/mg
Resolution: 1.93→60.35 Å / Cor.coef. Fo:Fc: 0.961 / Cor.coef. Fo:Fc free: 0.924 / SU B: 4.779 / SU ML: 0.137 / Cross valid method: THROUGHOUT / ESU R: 0.216 / ESU R Free: 0.195 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.27054
1553
5 %
RANDOM
Rwork
0.20673
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obs
0.2099
29336
94.22 %
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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