4Y1V
Complex of human Galectin-1 and Galbeta1-3GlcNAc
Experimental procedure
実験手法 | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSRRC BEAMLINE BL13C1 |
Synchrotron site | NSRRC |
Beamline | BL13C1 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-11-03 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.97622 |
Spacegroup name | P 21 21 21 |
格子定数 [Å] | 43.715, 58.291, 111.591 |
格子定数 [度] | 90.00, 90.00, 90.00 |
精密化法
残基 | 25.833 - 2.320 |
R因子 | 0.222 |
Rwork | 0.217 |
R-free | 0.26770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1w6n |
結合長の平均二乗偏差(RMSD) [Å] | 0.006 |
結合角の平均二乗偏差(RMSD) [度] | 0.971 |
Data scaling software | HKL-2000 |
Phasing software | PHASER (2.5.3) |
Refinement software | PHENIX |
Quality characteristics
Overall | Inner shell | Outer shell | |
分解能 [Å] (低) | 30.000 | 30.000 | 2.400 |
分解能 [Å] (高) | 2.320 | 4.990 | 2.320 |
Rmerge_l_obs | 0.041 | 0.027 | 0.208 |
Rmeas | 0.047 | 0.031 | 0.243 |
Rpim | 0.022 | 0.015 | 0.123 |
Total number of observations | 57534 | ||
独立反射数 | 12886 | ||
<I/σ(I)> | 18.2 | ||
完全性 [%] | 99.2 | 98.8 | 95.2 |
冗長性 | 4.5 | 4.1 | 3.8 |
CC(1/2) | 0.998 | 0.966 |
結晶化条件
結晶ID | 方法 | pH | 温度 | 溶液条件 |
1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | 0.1 M Tris (pH 8.0), 0.2 M Li2SO4, 30% (w/v) PEG 3350 |