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3KVR

Trapping of an oxocarbenium ion intermediate in UP crystals

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 24-ID-C
Synchrotron siteAPS
Beamline24-ID-C
Temperature [K]100
Detector technologyCCD
Collection date2007-03-16
DetectorADSC QUANTUM 315
Spacegroup nameP 41 21 2
格子定数 [Å]82.416, 82.416, 258.592
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基? - 2.600
R因子0.169
Rwork0.167
R-free0.20500
Structure solution methodMOLECULAR REPLACEMENT
結合長の平均二乗偏差(RMSD) [Å]0.008
結合角の平均二乗偏差(RMSD) [度]1.173
Refinement softwarePHENIX
Quality characteristics
 OverallOuter shell
分解能 [Å] (低)50.000
分解能 [Å] (高)2.6002.600
独立反射数28268
結晶化条件
結晶ID方法pH温度溶液条件
16.329518% PEG5K MME, 140 mM MgCl2, 100 mM MES, pH 6.3, vapor diffusion, hanging drop, temperature 295K

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件を2024-09-18に公開中

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