8FBT

Crystal structure of Cryptosporidium parvum N-myristoyltransferase with bound myristoyl-CoA

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2022-04-04
Detector	ADSC QUANTUM 315
Wavelength(s)	0.999989
Spacegroup name	P 1 21 1
Unit cell lengths	65.433, 105.338, 71.120
Unit cell angles	90.00, 112.48, 90.00

Refinement procedure

Resolution	49.830 - 2.200
R-factor	0.1663
Rwork	0.164
R-free	0.21720
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.177
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.20.1-4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.240
High resolution limit [Å]	2.200	2.200
Rmeas	0.083	0.703
Rpim	0.043	0.359
Number of reflections	45534	2260
<I/σ(I)>	19.11	2.06
Completeness [%]	100.0	100
Redundancy	3.8	3.8
CC(1/2)	0.996	0.772

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	CrpaA.18219.a.A42.PS38366 32 mg/mL was incubated with final concentrations of 0.7 mM Myristoyl-CoA at 4C for 30 min, then 0.6 microliter was mixed with 1:1 BisTris-HCl, pH 5.5, 25% PEG 3350. Cryo solution contained crystallant plus 27% PEG-400