6BMS

Palmitoyltransferase structure

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	97
Detector technology	CCD
Collection date	2016-07-08
Detector	MARRESEARCH
Wavelength(s)	0.9797
Spacegroup name	P 42 21 2
Unit cell lengths	186.402, 186.402, 90.177
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.213 - 2.441
R-factor	0.2339
Rwork	0.233
R-free	0.26080
Structure solution method	SAD
RMSD bond length	0.003
RMSD bond angle	0.598
Data reduction software	HKL-2000
Data scaling software	SCALEPACK
Phasing software	RESOLVE
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.490
High resolution limit [Å]	2.440	2.440
Rmerge	0.122	1.176
Rmeas	0.130	1.339
Rpim	0.042	0.618
Number of reflections	58992	2697
<I/σ(I)>	1.37	1.37
Completeness [%]	99.5	92.6
Redundancy	9.1	9.1
CC(1/2)		0.225

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	277	100mM sodium cacodylate pH-5.5 100mM Sodium potassium tartrate 20% PEG400