7OWQ
HsNMT1 in complex with both MyrCoA and peptide N-Methylated-GNCFSKPR
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-02-08 |
Detector | DECTRIS EIGER R 4M |
Wavelength(s) | 0.96775 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 93.655, 58.876, 154.207 |
Unit cell angles | 90.00, 92.06, 90.00 |
Refinement procedure
Resolution | 47.690 - 3.000 |
R-factor | 0.213 |
Rwork | 0.210 |
R-free | 0.25510 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5o9v |
RMSD bond length | 0.003 |
RMSD bond angle | 0.700 |
Data reduction software | XDS |
Data scaling software | Aimless |
Phasing software | MOLREP |
Refinement software | PHENIX (1.17_3644) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.690 | 3.180 |
High resolution limit [Å] | 3.000 | 3.000 |
Rpim | 0.058 | 0.265 |
Number of reflections | 32321 | 2710 |
<I/σ(I)> | 11.2 | 3 |
Completeness [%] | 98.6 | 98.7 |
Redundancy | 6.3 | 5.9 |
CC(1/2) | 0.993 | 0.856 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 293 | 21% PEG 8K, 0.1M sodum citrate, 0.1 M MgCl2, 0.2M NaCl |