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1csw

REPLACEMENTS IN A CONSERVED LEUCINE CLUSTER IN THE HYDROPHOBIC HEME POCKET OF CYTOCHROME C

Method: X-RAY DIFFRACTION D_max: 47.4 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1csw
deposition_date	1994-10-04
title	REPLACEMENTS IN A CONSERVED LEUCINE CLUSTER IN THE HYDROPHOBIC HEME POCKET OF CYTOCHROME C
keywords	ELECTRON TRANSPORT(HEME PROTEIN); ELECTRON TRANSPORT(HEME PROTEIN)
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	14.15 Å
rg_electron	12.84 Å
i0	3364720.00
molecular_weight	12833.0 kDa
excluded_volume	16041 Å³
envelope_volume	17298 Å³
shell_volume	11317 Å³
envelope_diameter	46.2 Å
shell_rg	18.77 Å
envelope_rg	13.29 Å
shape_rg	12.79 Å
total_rg	14.27 Å
total_atoms	899
n_residues	107
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	47.4 Å
rg_real	14.04 Å
rg_real_error	0.36 Å
i0_real	3.3650e+06
i0_real_error	4.0950e+04
rg_reciprocal	14.05 Å
i0_reciprocal	3365000.0000
total_estimate	0.8623
solution_quality	GOOD a GOOD solution
n_peaks	2
r_peak_primary	19.2 Å
skewness	0.120
kurtosis	-0.284
angular_range	— – 0.5000 Å⁻¹
current_alpha	0.0000
highest_alpha	697100.0000
n_real_points	80
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.739; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 1.000; Smooth: 0.988

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4. Crystallography & Experiment

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5. Entities & Polymer Info (4)

Entity 1 polymer

description	CYTOCHROME C
formula_weight	12131.9 kDa
src_method	man
entity_count	1

Polymer

type	polypeptide(L)
strand_id	A
atom_count	963

TEFKAGSAKKGATLFKTRCLQCHTVEKGGPHKVGPNLHGIFGRHSGQAEGYSYTDANIKKNVLWDENNMSEYLTNPKKYIPGTKMAFGGMKKEKDRNDLITYLKKATE

Source

organism	Saccharomyces cerevisiae
common_name	;baker's yeast ;
ncbi_taxonomy_id	4932

Entity 2 non-polymer

description	SULFATE ION
formula_weight	96.1 kDa
src_method	syn
entity_count	1

Entity 3 non-polymer

description	HEME C
formula_weight	618.5 kDa
src_method	syn
entity_count	1

Entity 4 water

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	64

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6. Citations (8)

Replacements in a conserved leucine cluster in the hydrophobic heme pocket of cytochrome c.

Protein Sci. (1995)

PMID: 7757009 PRIMARY

Structural Studies of the Roles of Residues 82 and 85 at the Interactive Face of Cytochrome C

Biochemistry (1995)

Oxidation State-Dependent Conformational Changes in Cytochrome C

J.Mol.Biol. (1992)

High-Resolution Refinement of Yeast Iso-1-Cytochrome C and Comparisons with Other Eukaryotic Cytochromes C

J.Mol.Biol. (1990)

A Polypeptide Chain-Refolding Event Occurs in the Gly82 Variant of Yeast Iso-1-Cytochrome C

J.Mol.Biol. (1989)

Crystallization of Yeast Iso-2-Cytochrome C Using a Novel Hair Seeding Technique

J.Mol.Biol. (1989)

Yeast Iso-1-Cytochrome C. A 2.8 Angstrom Resolution Three-Dimensional Structure Determination

J.Mol.Biol. (1988)

Role of Phenylalanine-82 in Yeast Iso-1-Cytochrome C and Remote Conformational Changes Induced by a Serine Residue at This Position

Biochemistry (1988)

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length_a	36.460 Å
length_b	36.460 Å
length_c	137.550 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	8

space_group	P 43 21 2
int_tables_number	96
crystal_system	—

resolution	1.900 Å
resolution_low	6.000 Å
r_factor	0.1790
r_work	—
r_free	—

fit	/app/data/saxs_computation/cs/1csw/1csw.fit
pddf	/app/data/pr_computation/cs/1csw/1csw.pr.out
profile	/app/data/saxs_computation/cs/1csw/1csw.dat