6PVA

The structure of NTMT1 in complex with compound 11

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 23-ID-D
Synchrotron site	APS
Beamline	23-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-07-15
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.0332
Spacegroup name	P 31 2 1
Unit cell lengths	73.012, 73.012, 82.172
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	29.510 - 1.840
R-factor	0.199
Rwork	0.196
R-free	0.23180
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6dtn
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	1.890
High resolution limit [Å]	1.840	1.840
Number of reflections	22463	1586
<I/σ(I)>	9.9	0.4
Completeness [%]	99.8	97.8
Redundancy	6.5	5.3
CC(1/2)	1.000	0.140

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	1.5 M lithium sulfate; 0.1 M sodium HEPES 7.5