105M

SPERM WHALE MYOGLOBIN N-BUTYL ISOCYANIDE AT PH 9.0

Experimental procedure

Source type	ROTATING ANODE
Source details	SIEMENS
Temperature [K]	292
Detector technology	IMAGE PLATE
Collection date	1993-07
Detector	RIGAKU
Spacegroup name	P 1 21 1
格子定数 [Å]	64.720, 30.061, 35.191
格子定数 [度]	90.00, 105.76, 90.00

精密化法

残基	5.000 - 2.020
R因子	0.174
Rwork	0.174
R-free	0.26800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	SPERM WHALE MYOGLOBIN NBNC WITHOUT LIGAND
結合長の平均二乗偏差(RMSD) [Å]	0.007
結合角の平均二乗偏差(RMSD) [度]	1.200
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	X-PLOR (3.851)
Refinement software	X-PLOR (3.851)

Quality characteristics

	Overall	Outer shell
分解能 [Å] (低)	6.000	2.030
分解能 [Å] (高)	2.020	2.020
Rmerge_l_obs	0.071	0.225
独立反射数	7987
完全性 [%]	90.7	90.9
冗長性	1.82	1.96

結晶化条件

結晶ID	方法	pH	温度	溶液条件
1		9		3.0 M AMMONIUM SULFATE, UNBUFFERED, pH 9.0