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1NA1

The structure of HRV14 when complexed with Pleconaril

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsAPS BEAMLINE 14-BM-C
Synchrotron siteAPS
Beamline14-BM-C
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-09-14
DetectorFUJI
Wavelength(s)1.00
Spacegroup nameP 21 3
格子定数 [Å]437.160, 437.160, 437.160
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基20.000 - 3.300
R因子0.223
Rwork0.222
R-free0.22800
Structure solution methodMOLECULAR REPLACEMENT
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]1.540

*

Data reduction softwareDENZO
Data scaling softwareCCP4 ((TRUNCATE))
Phasing softwareENVELOPE
Refinement softwareCNS (1.0)
Quality characteristics
 OverallOuter shell
分解能 [Å] (低)20.000
分解能 [Å] (高)3.3003.300
Rmerge_l_obs0.164

*

0.477

*

Total number of observations545390

*

独立反射数320952
完全性 [%]77.868.2

*

結晶化条件
結晶ID方法pH温度溶液条件
1VAPOR DIFFUSION, HANGING DROP7.5293HEPES, NaCl, CaCl2, PEG8K, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K
文献の結晶化試薬
ID結晶ID溶液試薬名濃度 (単位) (単位)詳細
11reservoirHEPES0.25 (M)
21reservoir0.25 (M)
31reservoir0.1 (M)
41reservoirPEG80000.3 (%)
51dropprotein20000 (mg/ml)

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件を2024-09-18に公開中

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