Mass: 18.015 Da / Num. of mol.: 253 / Source method: isolated from a natural source / Formula: H2O
Compound details
ENGINEERED RESIDUE IN CHAIN A, VAL 498 TO ARG ENGINEERED RESIDUE IN CHAIN A, LEU 502 TO ASP ...ENGINEERED RESIDUE IN CHAIN A, VAL 498 TO ARG ENGINEERED RESIDUE IN CHAIN A, LEU 502 TO ASP ENGINEERED RESIDUE IN CHAIN B, VAL 498 TO ARG ENGINEERED RESIDUE IN CHAIN B, LEU 502 TO ASP ENGINEERED RESIDUE IN CHAIN C, VAL 498 TO ARG ENGINEERED RESIDUE IN CHAIN C, LEU 502 TO ASP ENGINEERED RESIDUE IN CHAIN D, VAL 498 TO ARG ENGINEERED RESIDUE IN CHAIN D, LEU 502 TO ASP
Sequence details
STARTING RESIDUES SER186 AND MET187 ARE DUE TO CLONING
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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: 2.79 Å3/Da / Density % sol: 55.92 % / Description: NONE
Crystal grow
Details: 24% PEG4000, 100 MM LISO4, 100 MM TRIS (PH 8.2)
Resolution: 2.57→19.74 Å / Cor.coef. Fo:Fc: 0.963 / Cor.coef. Fo:Fc free: 0.942 / SU B: 20.02 / SU ML: 0.206 / Cross valid method: THROUGHOUT / ESU R: 0.529 / ESU R Free: 0.274 / Stereochemistry target values: MAXIMUM LIKELIHOOD Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. U VALUES WITH TLS ADDED
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.22989
2940
5.1 %
RANDOM
Rwork
0.18431
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-
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obs
0.1866
55064
99.63 %
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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