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6OTU

Crystal structure of a glucose-6-phosphate isomerase from Chlamydia trachomatis D/UW-3/Cx

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 21-ID-F
Synchrotron siteAPS
Beamline21-ID-F
Temperature [K]100
Detector technologyCCD
Collection date2019-03-21
DetectorMARMOSAIC 300 mm CCD
Wavelength(s)0.97872
Spacegroup nameP 42 2 2
格子定数 [Å]95.660, 95.660, 124.460
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基44.647 - 2.250
R因子0.1599
Rwork0.156
R-free0.22140
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)6bzb
結合長の平均二乗偏差(RMSD) [Å]0.007
結合角の平均二乗偏差(RMSD) [度]0.898
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareMOLREP
Refinement softwarePHENIX (1.15_3459)
Quality characteristics
 OverallInner shellOuter shell
分解能 [Å] (低)44.64744.6472.310
分解能 [Å] (高)2.25010.0602.250
Rmerge_l_obs0.1000.0320.599
Rmeas0.1050.0340.631
Total number of observations271137
独立反射数269763471995
<I/σ(I)>16.2542.643.45
完全性 [%]95.987.697.6
冗長性10.0518.2810.156
CC(1/2)0.9980.9990.876
結晶化条件
結晶ID方法pH温度溶液条件
1VAPOR DIFFUSION, SITTING DROP8.5287ChtrB.17127.a.B1.PW38523 at 18.94 mg/mL with 3 mM glucose-6-phosphate against MCSG3 screen condition C11 0.1 M Tris pH 8.5, 0.2 M ammonium acetate, 45% MPD, crystal tracking ID 305213c11, unique puck ID lyz8-7

217705

件を2024-03-27に公開中

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