5UTY

Crystal Structure of a Stabilized DS-SOSIP.mut4 BG505 gp140 HIV-1 Env Trimer, Containing Mutations I201C-P433C (DS), L154M, N300M, N302M, T320L in Complex with Human Antibodies PGT122 and 35O22 at 4.1 Angstrom

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	2016-08-04
Detector	RAYONIX MX300HE
Wavelength(s)	1
Spacegroup name	P 63
Unit cell lengths	131.447, 131.447, 312.348
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	41.481 - 3.412
R-factor	0.2437
Rwork	0.241
R-free	0.28820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4tvp
RMSD bond length	0.004
RMSD bond angle	0.861
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	3.520
High resolution limit [Å]	3.400	7.320	3.400
Rmerge	0.149	0.070	1.136
Rmeas	0.158	0.074	1.305
Rpim	0.053	0.024	0.618
Total number of observations	199781
Number of reflections	25676
<I/σ(I)>	5.5
Completeness [%]	61.0	99.4	17.4
Redundancy	7.8	9.9	2.5
CC(1/2)		0.997	0.345

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.6	293	10.5% PEG 4000, 0.2M AmSO4, 0.1M NaoAc pH 4.6