9IPR
Crystal structure of CTB10-M1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL10U2 |
| Synchrotron site | SSRF |
| Beamline | BL10U2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-06-22 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.97918 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 83.080, 88.114, 87.597 |
| Unit cell angles | 90.00, 116.66, 90.00 |
Refinement procedure
| Resolution | 36.260 - 1.940 |
| R-factor | 0.1927 |
| Rwork | 0.191 |
| R-free | 0.22620 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 9iku |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.040 |
| Data reduction software | xia2 |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | PHENIX ((1.20.1_4487: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.260 | 2.009 |
| High resolution limit [Å] | 1.940 | 1.940 |
| Rmerge | 0.072 | 0.387 |
| Rmeas | 0.080 | 0.455 |
| Rpim | 0.032 | 0.230 |
| Number of reflections | 82804 | 7618 |
| <I/σ(I)> | 12.62 | 3.06 |
| Completeness [%] | 99.0 | 91.72 |
| Redundancy | 5.7 | 3.7 |
| CC(1/2) | 0.995 | 0.818 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 291 | 20% isopropanol, 0.1 M MES monohydrate pH 5.5, 18%(W/V) PEG methyl ether 2000 |
