1JP6

Sperm Whale met-Myoglobin (room temperature; room pressure)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	295
Detector technology	AREA DETECTOR
Collection date	1997-09-08
Detector	UCSD MARK II
Wavelength(s)	1.541
Spacegroup name	P 1 21 1
Unit cell lengths	64.450, 30.930, 34.730
Unit cell angles	90.00, 105.73, 90.00

Refinement procedure

Resolution	9.200 * - 2.300
R-factor	0.16 *
Rwork	0.162
R-free	0.21700 *
Starting model (for MR)	1vxh
RMSD bond length	0.006
RMSD bond angle	1.021 *
Data scaling software	CCP4 ((SCALA))
Phasing software	CNS
Refinement software	CNS

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	9.200	2.420
High resolution limit [Å]	2.300	2.300
Rmerge	0.044	0.056
Number of reflections	5870
<I/σ(I)>	14.7	15.6
Completeness [%]	96.9	94.5
Redundancy	2.6	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	Batch method *	6	298	ammonium sulfate, pH 6, batch, temperature 298K

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	ammonium sulfate	72-78 (%sat)	pH5.5-6.0