7PZF

Crystal structure of the OmpK36 TD insertion chimera from Klebsiella pneumonia

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97625
Spacegroup name	P 1
Unit cell lengths	55.106, 73.428, 158.837
Unit cell angles	91.12, 97.17, 103.09

Refinement procedure

Resolution	54.250 - 1.499
R-factor	0.1909
Rwork	0.190
R-free	0.20530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6rd3
RMSD bond length	0.008
RMSD bond angle	0.990
Data reduction software	xia2
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	BUSTER (2.10.3 (19-MAR-2020))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	54.250	1.530
High resolution limit [Å]	1.499	1.500
Rmerge	0.087	0.806
Number of reflections	369351	17954
<I/σ(I)>	10	1
Completeness [%]	95.8
Redundancy	3.5
CC(1/2)	0.990	0.410

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	293	0.1 M Lithium sulfate, 0.1 M Sodium citrate, and 10% PEG 4000 (pH 5.6)