SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN ... SHEET THE SHEET STRUCTURE OF THIS MOLECULE IS BIFURCATED. IN ORDER TO REPRESENT THIS FEATURE IN THE SHEET RECORDS BELOW, TWO SHEETS ARE DEFINED.
Mass: 18.015 Da / Num. of mol.: 412 / Source method: isolated from a natural source / Formula: H2O
Sequence details
THE CONFLICT IN THE RECORDS BELOW HAS BEEN DESCRIBED IN REFERENCES WITH PUBMED ID=1658741, 7941740 ...THE CONFLICT IN THE RECORDS BELOW HAS BEEN DESCRIBED IN REFERENCES WITH PUBMED ID=1658741, 7941740 AND 7731988 INSIDE UNIPROT ENTRY P27616.
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Experimental details
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Experiment
Experiment
Method: X-RAY DIFFRACTION / Number of used crystals: 1
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Sample preparation
Crystal
Density Matthews: 2.1 Å3/Da / Density % sol: 41.5 %
Resolution: 2→23.95 Å / Cor.coef. Fo:Fc: 0.947 / Cor.coef. Fo:Fc free: 0.906 / SU B: 3.875 / SU ML: 0.113 / Cross valid method: THROUGHOUT / ESU R: 0.213 / ESU R Free: 0.186 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.238
1060
5.1 %
RANDOM
Rwork
0.173
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obs
0.177
19629
100 %
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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