Mass: 18.015 Da / Num. of mol.: 579 / Source method: isolated from a natural source / Formula: H2O
Compound details
ENGINEERED RESIDUE IN CHAIN A, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN B, CYS 19 TO ALA ...ENGINEERED RESIDUE IN CHAIN A, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN B, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN C, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN D, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN E, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN F, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN G, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN H, CYS 19 TO ALA
Sequence details
N-TERMINAL HIS-TAG CONSTRUCT WITH ENTEROKINASE CLEAVAGE SITE AND C19A MUTATION.
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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: 2.31 Å3/Da / Density % sol: 46.4 % / Description: NONE
Resolution: 2.32→48 Å / Cor.coef. Fo:Fc: 0.939 / Cor.coef. Fo:Fc free: 0.908 / SU B: 16.592 / SU ML: 0.202 / Cross valid method: THROUGHOUT / ESU R: 0.46 / ESU R Free: 0.275 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.26671
4052
5 %
RANDOM
Rwork
0.21737
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obs
0.21981
76978
100 %
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Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.4 Å / Solvent model: MASK