5OJY

Co-complex structure of regulator protein 2 (PamR2) with pamamycin 607 from Streptomyces alboniger

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	BESSY BEAMLINE 14.1
Synchrotron site	BESSY
Beamline	14.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-01-13
Detector	DECTRIS PILATUS3 2M
Wavelength(s)	0.9184
Spacegroup name	P 62 2 2
Unit cell lengths	107.850, 107.850, 119.300
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.700 - 1.851
R-factor	0.1832
Rwork	0.182
R-free	0.19600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5ojx
RMSD bond length	0.011
RMSD bond angle	1.083
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.7.17)
Refinement software	PHENIX

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	46.700	46.700	1.950
High resolution limit [Å]	1.850	10.000	1.850
Rmerge	0.075	0.029	1.588
Rmeas		0.030	1.625
Number of reflections	35445	288	5001
<I/σ(I)>	28.8	98.36	2.24
Completeness [%]	99.8	98.3	98.8
Redundancy	21.7	17.264	22.163
CC(1/2)	1.000	1.000	0.760

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		293	0.1M CHES pH 8.8, 0.7 M tri-sodium citrate, 0.14M tri-lithium citrate with 5mg/ml-1 protein (preincubated with 0.5 mM Pam607 (1:1 disolved in DMSO:MetOH), 10min on ice)