Mass: 18.015 Da / Num. of mol.: 317 / 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: 1.61 Å3/Da / Density % sol: 23.8 %
Crystal grow
Temperature: 293 K / Method: vapor diffusion, hanging drop Details: Type I crystals were harvested from protein drops (2.9 mg/ml) equilibrated against a reservoir of 1.3 M sodium citrate tribasic dihydrate, 0.1 M Sodium HEPES, pH 7.9. PH range: pH 7.9
Resolution: 1.72→60.89 Å / Cor.coef. Fo:Fc: 0.967 / Cor.coef. Fo:Fc free: 0.946 / SU B: 2.465 / SU ML: 0.08 / Cross valid method: THROUGHOUT / ESU R: 0.104 / ESU R Free: 0.111 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.23025
2706
5.1 %
RANDOM
Rwork
0.18007
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obs
0.1826
50591
99.35 %
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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