6BYB

Crystal structure of L3MBTL1 MBT Domain with MBK14970

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E SUPERBRIGHT
Temperature [K]	100
Detector technology	CCD
Collection date	2016-07-23
Detector	RIGAKU SATURN A200
Wavelength(s)	1.54178
Spacegroup name	P 21 21 2
Unit cell lengths	85.880, 93.166, 58.444
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.000 - 1.740
R-factor	0.2014
Rwork	0.200
R-free	0.22160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2rjd
RMSD bond length	0.010
RMSD bond angle	1.425
Data reduction software	HKL-3000
Data scaling software	SCALEPACK
Phasing software	PHASER (2.6.1)
Refinement software	REFMAC (5.8.0189)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.770
High resolution limit [Å]	1.740	4.720	1.740
Rmerge	0.075	0.035	0.748
Rmeas	0.082	0.039	0.841
Rpim	0.031	0.015	0.376
Total number of observations	325154
Number of reflections	48892	2632	2336
<I/σ(I)>	10.7
Completeness [%]	99.8	98.8	97.3
Redundancy	6.7	6.2	4.7
CC(1/2)		0.999	0.650

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	295	30% PEG 400, 0.2 M Magnesium chloride hexahydrate, 0.1 M Sodium HEPES pH7.5