4YP5
Crystal structure of Methanobacterium thermoautotrophicum NMNAT in complex with NADP
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 14-BM-C |
| Synchrotron site | APS |
| Beamline | 14-BM-C |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2000-11-01 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.0000 |
| Spacegroup name | P 31 2 1 |
| Unit cell lengths | 124.586, 124.586, 111.959 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 20.000 - 2.210 |
| R-factor | 0.1814 |
| Rwork | 0.181 |
| R-free | 0.19550 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ej2 |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.586 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.310 |
| High resolution limit [Å] | 2.210 | 2.210 |
| Rmerge | 0.052 | 0.255 |
| Number of reflections | 45535 | |
| <I/σ(I)> | 15.68 | 4.84 |
| Completeness [%] | 89.3 | 87 |
| Redundancy | 1.27 | 1.15 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8 | 298 | ammonium sulfate, glycerol, TRIS, NADP |
