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6FMW

IMISX-EP of Hg-BacA cocrystallization

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsSLS BEAMLINE X06SA
Synchrotron siteSLS
BeamlineX06SA
Temperature [K]100
Detector technologyPIXEL
Collection date2016-10-23
DetectorDECTRIS EIGER X 16M
Wavelength(s)1.9
Spacegroup nameC 2 2 2
格子定数 [Å]114.060, 145.130, 39.990
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基44.536 - 2.600
R因子0.2256
Rwork0.224
R-free0.25430
Structure solution methodSAD
結合長の平均二乗偏差(RMSD) [Å]0.003
結合角の平均二乗偏差(RMSD) [度]0.640
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwareSHELXCD
Refinement softwarePHENIX ((1.13rc1_2954: ???))
Quality characteristics
 OverallOuter shell
分解能 [Å] (低)44.5362.670
分解能 [Å] (高)2.6002.600
Rmeas0.3802.000
独立反射数196711467
<I/σ(I)>8.951.96
完全性 [%]99.099
冗長性20.715.7
結晶化条件
結晶ID方法pH温度溶液条件
1LIPIDIC CUBIC PHASE29340 % PEG-400, 0.3-0.5 M ammonium citrate dibasic and 0.1 M sodium citrate pH 5.0

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件を2024-09-18に公開中

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