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.: 556 / Source method: isolated from a natural source / Formula: H2O
Sequence details
MUTATION C340S
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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: 2.55 Å3/Da / Density % sol: 51.88 % / Description: NONE
Crystal grow
Details: FCU3-4 AT 3MG/ML, 40MM POTASSIUM PHOSPHATE, 16% PEG8000, 20% GLYCEROL. 100NL DROPS DISPENSED BY A MOSQUITO ROBOT ON MRC/WILDEN PLATES. PLATES KEPT AT 255K.
Resolution: 1.75→49.57 Å / SU ML: 0.18 / σ(F): 1.36 / Phase error: 17.25 / Stereochemistry target values: ML Details: 22 TLS GROUPS. REFINEMENT SOFTWARE ADDS THE TLS COMPONENT TO THE ANISOU RECORD OF THE PDB FILE. ATOMIC TEMPERATURE FACTORS WERE NOT REFINED ANISOTROPICALLY.
Rfactor
Num. reflection
% reflection
Rfree
0.196
2818
5 %
Rwork
0.169
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obs
0.171
56158
99.4 %
Solvent computation
Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL / Bsol: 57.4 Å2 / ksol: 0.37 e/Å3