6GYA
Amylase in complex with branched ligand
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04 |
| Synchrotron site | Diamond |
| Beamline | I04 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2014-04-24 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.98 |
| Spacegroup name | P 61 |
| Unit cell lengths | 212.180, 212.180, 172.220 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 66.860 - 2.950 |
| R-factor | 0.15737 |
| Rwork | 0.156 |
| R-free | 0.18324 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6gxv |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.787 |
| Data scaling software | Aimless (0.7.1) |
| Phasing software | MOLREP (11.6.03) |
| Refinement software | REFMAC (5.8.0232) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 66.900 | 3.030 |
| High resolution limit [Å] | 2.950 | 2.960 |
| Rmerge | 0.120 | 0.740 |
| Rmeas | 0.140 | 0.830 |
| Number of reflections | 92496 | 6812 |
| <I/σ(I)> | 13.4 | |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 10 | 10.5 |
| CC(1/2) | 0.998 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 8.5 | 293 | 20% PEG3350, 0.1M BTP pH 8.5, 0.2% Na2SO4 |
