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6A2D

Crystal structure of a synthase 2 from santalum album in complex with ligand1

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSRRC BEAMLINE BL13B1
Synchrotron siteNSRRC
BeamlineBL13B1
Temperature [K]100
Detector technologyCCD
Collection date2016-05-21
DetectorADSC QUANTUM 315r
Wavelength(s)1.0
Spacegroup nameP 43 21 2
格子定数 [Å]132.527, 132.527, 141.903
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基24.840 - 1.960
R因子0.1816
Rwork0.180
R-free0.22250
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2ong
結合長の平均二乗偏差(RMSD) [Å]0.010
結合角の平均二乗偏差(RMSD) [度]1.453
Data reduction softwareHKL-2000
Data scaling softwareHKL-2000
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0258)
Quality characteristics
 OverallInner shellOuter shell
分解能 [Å] (低)25.00025.0002.030
分解能 [Å] (高)1.9604.2201.960
Rmerge_l_obs0.0930.0290.866
Rmeas0.1010.0310.939
Rpim0.0390.0120.360
Total number of observations606547
独立反射数9098295728973
<I/σ(I)>8
完全性 [%]100.0100100
冗長性6.76.36.8
CC(1/2)0.9990.735
結晶化条件
結晶ID方法pH温度溶液条件
1VAPOR DIFFUSION, HANGING DROP7285AMMONIUM TARTRATE, PEG 3350, MGCL2

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件を2024-09-18に公開中

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