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3F58

IGG1 FAB FRAGMENT (58.2) COMPLEX WITH 12-RESIDUE CYCLIC PEPTIDE (INCLUDING RESIDUES 315-324 OF HIV-1 GP120 (MN ISOLATE); H315S MUTATION

Experimental procedure
実験手法SINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsMACSCIENCE M18X
Temperature [K]295
Detector technologyAREA DETECTOR
Collection date1992-05-01
DetectorSIEMENS
Spacegroup nameP 21 21 2
格子定数 [Å]95.470, 115.460, 49.580
格子定数 [度]90.00, 90.00, 90.00
精密化法
残基48.000 - 2.800
R因子0.2
Rwork0.200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)FAB PORTION OF 1ACY
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]1.500
Data reduction softwareX-GEN
Data scaling softwareX-GEN
Phasing softwareMERLOT
Refinement softwareX-PLOR (3.851)
Quality characteristics
 OverallOuter shell
分解能 [Å] (低)47.8002.980
分解能 [Å] (高)2.8002.800
Rmerge_l_obs0.072

*

0.218

*

Total number of observations47266

*

独立反射数139512259

*

<I/σ(I)>13.21.5
完全性 [%]98.997.7
冗長性3.42.4
結晶化条件
結晶ID方法pH温度溶液条件
1Vapor diffusion, sitting drop

*

522.5

*

pH 5.0
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
11reservoirPEG400016 (%)
21reservoirimidazole malate0.2 (M)
31droppeptide2.4 times Fab molar
41dropFab15 (mg/ml)

217705

件を2024-03-27に公開中

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