6FZ2

Human N-myristoyltransferase (NMT1) with Myristoyl-CoA and inhibitor bound

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER AXS MICROSTAR-H
Temperature [K]	110
Detector technology	IMAGE PLATE
Collection date	2017-06-12
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.54179
Spacegroup name	C 1 2 1
Unit cell lengths	92.530, 58.290, 153.900
Unit cell angles	90.00, 92.52, 90.00

Refinement procedure

Resolution	16.800 - 2.050
R-factor	0.23876
Rwork	0.237
R-free	0.27786
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6fz5
RMSD bond length	0.010
RMSD bond angle	1.446
Data reduction software	XDS (0.5.436)
Data scaling software	pointless (0.5.436)
Phasing software	PHASER
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	16.800	2.100
High resolution limit [Å]	2.050	2.050
Rmerge	0.139	0.680
Rmeas	0.164	0.798
Rpim	0.085	0.414
Number of reflections	51372	3863
<I/σ(I)>	6.2	1.9
Completeness [%]	99.3	99.6
Redundancy	3.6	3.6
CC(1/2)	0.990	0.636

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.5	293	24% PEG 4000 5 mM NiCl2 0.1 M Na citrate 5% Glycerol