1MVQ
Cratylia mollis lectin (isoform 1) in complex with methyl-alpha-D-mannose
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | LNLS BEAMLINE D03B-MX1 |
Synchrotron site | LNLS |
Beamline | D03B-MX1 |
Temperature [K] | 277 |
Detector technology | IMAGE PLATE |
Detector | MARRESEARCH |
Wavelength(s) | 1.38 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 63.449, 77.956, 105.323 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 9.940 - 1.770 |
R-factor | 0.14173 |
Rwork | 0.140 |
R-free | 0.17000 * |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5cna |
RMSD bond length | 0.015 |
RMSD bond angle | 1.599 |
Data reduction software | DENZO |
Data scaling software | SCALEPACK |
Phasing software | AMoRE |
Refinement software | REFMAC (5.1.09) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 9.940 | 1.810 |
High resolution limit [Å] | 1.770 | 1.770 |
Rmerge | 0.068 * | 0.345 * |
Number of reflections | 25553 | |
<I/σ(I)> | 4.9 | |
Completeness [%] | 99.6 | 98.1 |
Redundancy | 3.8 * | 3.7 * |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | Vapor diffusion, hanging drop * | 4.5 | 291 * | Tavares, G.A., (1996) Acta Crystallogr., D52, 1046. * |
Crystallization Reagents in Literatures
ID | crystal ID | solution | reagent name | concentration (unit) | details |
1 | 1 | drop | protein | 12 (mg/ml) | |
2 | 1 | reservoir | sodium acetate | 0.01 (M) | pH4.5 |
3 | 1 | reservoir | 0.15 (M) | ||
4 | 1 | reservoir | PEG6000 | 9 (%(w/v)) | |
5 | 1 | reservoir | 0.01 (M) | ||
6 | 1 | reservoir | methyl-alpha-D-mannopyranoside | 0.15 (M) |