Mass: 18.015 Da / Num. of mol.: 274 / Source method: isolated from a natural source / Formula: H2O
Compound details
N TERMINAL HIS TAG (MGSSHHHHHHSSGLVPRGSH): ONLY TRACES OF RESIDUE HIS 0 VISIBLE IN E-DENSITY C- ...N TERMINAL HIS TAG (MGSSHHHHHHSSGLVPRGSH): ONLY TRACES OF RESIDUE HIS 0 VISIBLE IN E-DENSITY C-TERMINAL: RG BACKBONE ONLY MODELLED, T NOT VISIBLE C-TERMINAL CLONING ARTFACTS (GSV) FROM BAMH1 AND STOP CODON ALSO ABSENT.
Sequence details
N TERMINAL AND C TERMINAL TAGS IN CONSTRUCT
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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: 2.14 Å3/Da / Density % sol: 42.65 %
Crystal grow
Method: vapor diffusion, sitting drop / pH: 5.5 Details: 0.5 + 0.5 UL SITTING DROPS IN INTELLIPLATES, 0.1 M NA-CITRATE BUFFER, PH 5.5, 46% PEG-MME 2K AND 3 % LDAO B-MERCAPTO-ETHANOL IN PROTEIN STOCK
Resolution: 1.7→25 Å / Cor.coef. Fo:Fc: 0.96 / Cor.coef. Fo:Fc free: 0.944 / SU B: 2.843 / SU ML: 0.092 / Cross valid method: THROUGHOUT / ESU R: 0.124 / ESU R Free: 0.125 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.249
1138
4.8 %
RANDOM
Rwork
0.201
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obs
0.203
22589
99.3 %
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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: BABINET MODEL WITH MASK