7OWM

HsNMT1 in complex with both MyrCoA and HCPA substrate peptide GKQNSKLR

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.98400
Spacegroup name	P 21 21 2
Unit cell lengths	79.879, 178.380, 58.255
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.770 - 1.500
R-factor	0.1564
Rwork	0.154
R-free	0.19580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5o9t
RMSD bond length	0.006
RMSD bond angle	0.874
Data reduction software	XDS
Data scaling software	STARANISO
Phasing software	PHASER
Refinement software	PHENIX (1.17_3644)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.773	1.540
High resolution limit [Å]	1.500	1.500
Rmerge	0.115	1.532
Rpim	0.032	0.541
Number of reflections	128545	6425
<I/σ(I)>	12.2	1.4
Completeness [%]	98.4	97.8
Redundancy	13.9	8.9
CC(1/2)	0.998	0.648

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	293	20% PEG8K, 100mM Sodium Citrate pH 5.6, 100mM MgCl2, 100mM NaCl