HUMAN LYSOZYME MUTANT A96L COMPLEXED WITH CHITOTRIOSE

Method: X-RAY DIFFRACTION D_max: 65.2 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1bb5
deposition_date	1998-04-28
title	HUMAN LYSOZYME MUTANT A96L COMPLEXED WITH CHITOTRIOSE
keywords	HYDROLASE, LYSOZYME, GLYCOSIDASE; HYDROLASE
method	X-RAY DIFFRACTION

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Download Data

SAXS curve (.dat) P(r) distribution (.pr.out) Structure (CIF)

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2. SAXS Parameters (CRYSOL)

rg_guinier	20.10 Å
rg_electron	19.11 Å
i0	18805000.00
molecular_weight	30761.0 kDa
excluded_volume	37628 Å³
envelope_volume	43042 Å³
shell_volume	19059 Å³
envelope_diameter	65.5 Å
shell_rg	25.01 Å
envelope_rg	19.26 Å
shape_rg	19.09 Å
total_rg	19.91 Å
total_atoms	2150
n_residues	260
n_harmonics	20
q_range	— – 0.5000 Å⁻¹
n_points	101
shell_type	directional
solvent_density	0.3340 e/Å³
contrast_shell	0.0300 e/Å³
crysol_version	4.1.3

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3. P(r) Analysis (GNOM)

dmax	65.2 Å
rg_real	20.05 Å
rg_real_error	0.36 Å
i0_real	1.8810e+07
i0_real_error	2.2010e+05
rg_reciprocal	20.06 Å
i0_reciprocal	18810000.0000
total_estimate	0.8968
solution_quality	GOOD a GOOD solution
n_peaks	2
r_peak_primary	23.3 Å
skewness	0.279
kurtosis	-0.353
angular_range	— – 0.3950 Å⁻¹
current_alpha	0.0000
highest_alpha	3102000.0000
n_real_points	71
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.885; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 1.000; Smooth: 0.998

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4. Crystallography & Experiment

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5. Entities & Polymer Info (3)

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6. Citations (0)

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length_a	42.940 Å
length_b	64.810 Å
length_c	109.140 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	8

space_group	P 21 21 21
int_tables_number	19
crystal_system	—

resolution	1.800 Å
resolution_low	23.000 Å
r_factor	0.2000
r_work	0.2000
r_free	0.2600

description	LYSOZYME
formula_weight	14762.8 kDa
ec_number	3.2.1.17
mutation	A96L
src_method	man
entity_count	2

type	polypeptide(L)
strand_id	A,B
atom_count	2439

HUMAN LYSOZYME MUTANT A96L COMPLEXED WITH CHITOTRIOSE

SAXS Profile

P(r) Distribution

1. Structure Basics

Download Data

2. SAXS Parameters (CRYSOL)

3. P(r) Analysis (GNOM)

4. Crystallography & Experiment

Unit Cell

Symmetry

Refinement

Diffraction

5. Entities & Polymer Info (3)

Entity 1 polymer

Polymer

Source

Entity 2 branched

Entity 3 water

6. Citations (0)

7. Files & Curves (10)

Files (7)

Curves (3)

organism	Homo sapiens
common_name	human
ncbi_taxonomy_id	9606
host_organism	Pichia pastoris

description	;2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose ;
formula_weight	627.6 kDa
src_method	man
entity_count	2

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	289

fit	/app/data/saxs_computation/bb/1bb5/1bb5.fit
pddf	/app/data/pr_computation/bb/1bb5/1bb5.pr.out
profile	/app/data/saxs_computation/bb/1bb5/1bb5.dat