;XYLANASE FROM PENICILLIUM SIMPLICISSIMUM, COMPLEX WITH 1,2-(4-DEOXY-BETA-L-THREO-HEX-4-ENOPYRANOSYLURONIC ACID)-BETA-1,4-XYLOTRIOSE) ;

Method: X-RAY DIFFRACTION D_max: 60.6 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1b30
deposition_date	1998-12-15
title	;XYLANASE FROM PENICILLIUM SIMPLICISSIMUM, COMPLEX WITH 1,2-(4-DEOXY-BETA-L-THREO-HEX-4-ENOPYRANOSYLURONIC ACID)-BETA-1,4-XYLOTRIOSE) ;
keywords	FAMILY 10 XYLANASE, PENICILLIUM SIMPLICISSIMUM, GLYCOSYL HYDROLASE, SUBSTRATE BINDING; FAMILY 10 XYLANASE
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	19.26 Å
rg_electron	18.18 Å
i0	18580300.00
molecular_weight	32951.0 kDa
excluded_volume	41228 Å³
envelope_volume	44064 Å³
shell_volume	19934 Å³
envelope_diameter	62.0 Å
shell_rg	24.84 Å
envelope_rg	18.38 Å
shape_rg	18.17 Å
total_rg	19.10 Å
total_atoms	2326
n_residues	301
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	60.6 Å
rg_real	19.14 Å
rg_real_error	0.35 Å
i0_real	1.8580e+07
i0_real_error	2.3240e+05
rg_reciprocal	19.16 Å
i0_reciprocal	18580000.0000
total_estimate	0.8151
solution_quality	GOOD a GOOD solution
n_peaks	2
r_peak_primary	23.6 Å
skewness	0.197
kurtosis	-0.370
angular_range	— – 0.4150 Å⁻¹
current_alpha	0.0000
highest_alpha	4690000.0000
n_real_points	73
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.867; Stabil: 0.999; Sysdev: 1.000; Positv: 1.000; Valcen: 0.993; Smooth: 0.000

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4. Crystallography & Experiment

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5. Entities & Polymer Info (3)

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6. Citations (2)

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length_a	81.300 Å
length_b	81.300 Å
length_c	113.170 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	120.00 °
z_pdb	6

space_group	P 31 2 1
int_tables_number	152
crystal_system	—

resolution	2.250 Å
resolution_low	15.000 Å
r_factor	—
r_work	0.2040
r_free	0.2610

description	PROTEIN (XYLANASE)
formula_weight	32566.5 kDa
ec_number	3.2.1.8
src_method	nat
entity_count	1

type	polypeptide(L)
strand_id	A
atom_count	2577

;XYLANASE FROM PENICILLIUM SIMPLICISSIMUM, COMPLEX WITH 1,2-(4-DEOXY-BETA-L-THREO-HEX-4-ENOPYRANOSYLURONIC ACID)-BETA-1,4-XYLOTRIOSE) ;

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

Entity 2 branched

Entity 3 water

6. Citations (2)

7. Files & Curves (10)

Files (7)

Curves (3)

description	beta-D-xylopyranose-(1-4)-beta-D-xylopyranose-(1-4)-beta-D-xylopyranose
formula_weight	414.4 kDa
src_method	man
entity_count	1

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	245

fit	/app/data/saxs_computation/b3/1b30/1b30.fit
pddf	/app/data/pr_computation/b3/1b30/1b30.pr.out
profile	/app/data/saxs_computation/b3/1b30/1b30.dat