5O9T
HsNMT1 in complex with CoA and acetylated-NCFSKPK peptide
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-1 |
Synchrotron site | ESRF |
Beamline | MASSIF-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-04-01 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 0.9660 |
Spacegroup name | P 2 21 21 |
Unit cell lengths | 58.221, 79.641, 178.991 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.750 - 2.150 |
R-factor | 0.1674 |
Rwork | 0.165 |
R-free | 0.21580 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4c2z |
RMSD bond length | 0.008 |
RMSD bond angle | 0.947 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX ((1.10.1_2155: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 48.800 | 2.270 |
High resolution limit [Å] | 2.150 | 2.150 |
Rpim | 0.039 | 0.190 |
Number of reflections | 46155 | 4517 |
<I/σ(I)> | 14.7 | 4.6 |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.6 | 6.2 |
CC(1/2) | 0.998 | 0.902 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | 21% PEG 6000, 0.1M sodium citrate pH 5.6, 0.1M Magnesium chloride, 0.1M sodium chloride. |