7SZ9

Crosslinked Crystal Structure of Type II Fatty Acid Synthase Ketosynthase, FabB, and C16:1-crypto Acyl Carrier Protein, AcpP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-03-06
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0
Spacegroup name	P 1 21 1
Unit cell lengths	59.450, 103.580, 79.280
Unit cell angles	90.00, 108.28, 90.00

Refinement procedure

Resolution	54.020 - 2.200
R-factor	0.2105
Rwork	0.208
R-free	0.25540
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6okc
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	75.280	60.900	2.240
High resolution limit [Å]	2.200	11.220	2.200
Rmerge	0.205
Rmeas	0.238
Rpim	0.117
Number of reflections	38093	372	1412
<I/σ(I)>	3.7
Completeness [%]	82.1	98.3	53.9
Redundancy	2.1
CC(1/2)	0.945	0.986	0.576

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	281	20% PEG 8000, 0.3 M sodium acetate, 0.1 M sodium cacodylate