1HHU
Balhimycin in complex with D-Ala-D-Ala
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | EMBL/DESY, HAMBURG BEAMLINE X11 |
| Synchrotron site | EMBL/DESY, HAMBURG |
| Beamline | X11 |
| Temperature [K] | 100 |
| Detector technology | IMAGE PLATE |
| Collection date | 1998-09-15 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 22.705, 27.986, 44.490 |
| Unit cell angles | 90.00, 93.18, 90.00 |
Refinement procedure
| Resolution | 27.990 - 0.890 |
| R-factor | 0.0835 |
| R-free | 0.10040 |
| Structure solution method | DIRECT METHODS |
| RMSD bond length | 0.027 |
| RMSD bond angle | 0.042 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHELX |
| Refinement software | SHELXL-97 |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 27.990 | 1.000 |
| High resolution limit [Å] | 0.890 | 0.890 |
| Rmerge | 0.017 | 0.034 |
| Number of reflections | 42306 | |
| <I/σ(I)> | 38.76 | 24.67 |
| Completeness [%] | 99.4 | 98.1 |
| Redundancy | 3.66 | 3.35 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 1M CIT, PH =7, 25% MPD |
