6OKD

Crystal Structure of human transferrin receptor in complex with a cystine-dense peptide

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-21
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	C 1 2 1
Unit cell lengths	102.601, 145.500, 133.494
Unit cell angles	90.00, 90.02, 90.00

Refinement procedure

Resolution	50.010 - 1.850
R-factor	0.16405
Rwork	0.163
R-free	0.18714
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	pdbid 1de4
RMSD bond length	0.016
RMSD bond angle	1.611
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER (2.7.17)
Refinement software	REFMAC (5.8.0158)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.880
High resolution limit [Å]	1.850	5.020	1.850
Rmerge	0.086	0.038	0.693
Rmeas	0.103	0.045	0.824
Rpim	0.056	0.024	0.441
Total number of observations	551226
Number of reflections	166017	8405	8198
<I/σ(I)>	8.3
Completeness [%]	99.8	99.5	99.9
Redundancy	3.3	3.4	3.3
CC(1/2)		0.998	0.664

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION	6.5	298	PEG 6000, Mes