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 |