6QGX

Crystal structure of E.coli BamA beta-barrel in complex with nanobody F7

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-02-02
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.99998
Spacegroup name	P 21 21 21
Unit cell lengths	49.321, 80.335, 135.349
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.340 - 2.200
R-factor	0.2309
Rwork	0.229
R-free	0.26590
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4n75
RMSD bond length	0.004
RMSD bond angle	0.587
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.340	2.270
High resolution limit [Å]	2.200	2.200
Rmerge	0.104	0.572
Rpim	0.062	0.374
Number of reflections	27754	2725
<I/σ(I)>	10.4	1.8
Completeness [%]	99.3	99.5
Redundancy	6	5.5
CC(1/2)	0.992	0.826

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	33% PEG 400, 0.23 M NaCl, 0.05 M sodium acetate