8HHD

Crystal structure of PaMurU

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 7A (6B, 6C1)
Synchrotron site	PAL/PLS
Beamline	7A (6B, 6C1)
Temperature [K]	100
Detector technology	CCD
Collection date	2018-10-31
Detector	ADSC QUANTUM 270
Wavelength(s)	0.979
Spacegroup name	P 31
Unit cell lengths	76.509, 76.509, 97.935
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.650 - 2.270
R-factor	0.1835
Rwork	0.180
R-free	0.23760
Structure solution method	MAD
RMSD bond length	0.009
RMSD bond angle	1.155
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.310
High resolution limit [Å]	2.270	2.270
Number of reflections	29509	1478
<I/σ(I)>	16.2
Completeness [%]	100.0
Redundancy	11.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		296	0.06M NaCl, 0.1M HEPES pH8.0, 1.6M Ammonium sulfate, 0.1M Lithium sulfate