104M
SPERM WHALE MYOGLOBIN N-BUTYL ISOCYANIDE AT PH 7.0
Experimental procedure
| Source type | ROTATING ANODE |
| Source details | SIEMENS |
| Temperature [K] | 292 |
| Detector technology | IMAGE PLATE |
| Collection date | 1994-03 |
| Detector | RIGAKU |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 64.730, 30.910, 34.828 |
| Unit cell angles | 90.00, 105.41, 90.00 |
Refinement procedure
| Resolution | 5.000 - 1.710 |
| R-factor | 0.154 |
| Rwork | 0.154 |
| R-free | 0.22500 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | SPERM WHALE MYOGLOBIN NBNC MINUS LIGAND |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.400 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | X-PLOR (3.851) |
| Refinement software | X-PLOR (3.851) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 6.000 | 1.720 |
| High resolution limit [Å] | 1.710 | 1.710 |
| Rmerge | 0.040 | 0.172 |
| Number of reflections | 13484 | |
| Completeness [%] | 92.0 | 92.4 |
| Redundancy | 3.19 | 3.03 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 3.0 M AMMONIUM SULFATE, UNBUFFERED, pH 7.0 |
