5KOY

Mouse pgp 34 linker deleted bound with ATP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	CCD
Collection date	2014-03-14
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	1.00
Spacegroup name	P 21 21 21
Unit cell lengths	97.520, 116.439, 375.052
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	21.302 - 3.850
R-factor	0.2481
Rwork	0.246
R-free	0.28880
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5kpd
RMSD bond length	0.007
RMSD bond angle	1.031
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	MOLREP
Refinement software	PHENIX (1.11.1_2575)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	34.724	50.000	3.870
High resolution limit [Å]	3.800	10.290	3.800
Rmerge	0.132	0.067	0.997
Rmeas	0.131
Rpim	0.035
Total number of observations	611650
Number of reflections	42251
<I/σ(I)>	6.1
Completeness [%]	99.9	99	99.5
Redundancy	14.5	15.9	9.5
CC(1/2)		0.998	0.372

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	9	277	100 mM glycine pH 9.0, 150 mM NaCl, 31% PEG400. After crystals grew, crystals were soaked in cryoprotectant solution with 18 mM ATP