3UIV
Human serum albumin-myristate-amantadine hydrochloride complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 24-ID-C |
Synchrotron site | APS |
Beamline | 24-ID-C |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2011-06-28 |
Detector | BRUKER SMART 6500 |
Wavelength(s) | 1 |
Spacegroup name | P 1 |
Unit cell lengths | 38.270, 93.516, 96.217 |
Unit cell angles | 74.91, 89.75, 80.04 |
Refinement procedure
Resolution | 37.389 - 2.200 |
R-factor | 0.2295 |
Rwork | 0.226 |
R-free | 0.29020 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1bj5 |
RMSD bond length | 0.008 |
RMSD bond angle | 1.126 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | AMoRE |
Refinement software | REFMAC (5.5.0088) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 40.000 | |
High resolution limit [Å] | 2.100 | 2.100 |
Number of reflections | 66700 | |
Completeness [%] | 95.0 | 95 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 298 | 32% (w/v) polyethylene glycol 3350, 50mM potassium phosphate (pH 7.5), 5% glycerol, 3% DMSO, 2% MPD, VAPOR DIFFUSION, SITTING DROP, temperature 298K |