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1e7e

HUMAN SERUM ALBUMIN COMPLEXED WITH DECANOIC ACID (CAPRIC ACID)

Method: X-RAY DIFFRACTION D_max: 90.5 Å Quality: EXCELLENT

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1e7e
deposition_date	2000-08-29
title	HUMAN SERUM ALBUMIN COMPLEXED WITH DECANOIC ACID (CAPRIC ACID)
keywords	PLASMA PROTEIN, METAL-BINDING, LIPID-BINDING; PLASMA 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	28.75 Å
rg_electron	27.60 Å
i0	67927200.00
molecular_weight	65096.0 kDa
excluded_volume	81752 Å³
envelope_volume	103590 Å³
shell_volume	31952 Å³
envelope_diameter	93.6 Å
shell_rg	34.29 Å
envelope_rg	27.53 Å
shape_rg	27.61 Å
total_rg	28.27 Å
total_atoms	4561
n_residues	582
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	90.5 Å
rg_real	28.68 Å
rg_real_error	0.79 Å
i0_real	6.7930e+07
i0_real_error	9.3680e+05
rg_reciprocal	28.71 Å
i0_reciprocal	67930000.0000
total_estimate	0.9075
solution_quality	EXCELLENT a EXCELLENT solution
n_peaks	0
r_peak_primary	— Å
skewness	0.226
kurtosis	-0.522
angular_range	— – 0.2750 Å⁻¹
current_alpha	0.0000
highest_alpha	9188000.0000
n_real_points	56
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.949; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.998; Smooth: 0.950

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4. Crystallography & Experiment

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5. Entities & Polymer Info (3)

Entity 1 polymer

description	SERUM ALBUMIN
formula_weight	66571.2 kDa
src_method	man
entity_count	1

Polymer

type	polypeptide(L)
strand_id	A
atom_count	4591

DAHKSEVAHRFKDLGEENFKALVLIAFAQYLQQCPFEDHVKLVNEVTEFAKTCVADESAENCDKSLHTLFGDKLCTVATLRETYGEMADCCAKQEPERNECFLQHKDDNPNLPRLVRPEVDVMCTAFHDNEETFLKKYLYEIARRHPYFYAPELLFFAKRYKAAFTECCQAADKAACLLPKLDELRDEGKASSAKQRLKCASLQKFGERAFKAWAVARLSQRFPKAEFAEVSKLVTDLTKVHTECCHGDLLECADDRADLAKYICENQDSISSKLKECCEKPLLEKSHCIAEVENDEMPADLPSLAADFVESKDVCKNYAEAKDVFLGMFLYEYARRHPDYSVVLLLRLAKTYETTLEKCCAAADPHECYAKVFDEFKPLVEEPQNLIKQNCELFEQLGEYKFQNALLVRYTKKVPQVSTPTLVEVSRNLGKVGSKCCKHPEAKRMPCAEDYLSVVLNQLCVLHEKTPVSDRVTKCCTESLVNRRPCFSALEVDETYVPKEFNAETFTFHADICTLSEKERQIKKQTALVELVKHKPKATKEQLKAVMDDFAAFVEKCCKADDKETCFAEEGKKLVAASQAALGL

Source

organism	HOMO SAPIENS
common_name	HUMAN
ncbi_taxonomy_id	9606
host_organism	SACCHAROMYCES CEREVISIAE

Entity 2 non-polymer

description	DECANOIC ACID
formula_weight	172.3 kDa
src_method	syn
entity_count	10

Entity 3 water

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	30

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6. Citations (1)

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length_a	186.780 Å
length_b	39.190 Å
length_c	95.340 Å
angle_alpha	90.00 °
angle_beta	105.15 °
angle_gamma	90.00 °
z_pdb	4

space_group	C 1 2 1
int_tables_number	5
crystal_system	—

resolution	2.500 Å
resolution_low	40.000 Å
r_factor	0.2200
r_work	0.2200
r_free	0.2710

fit	/app/data/saxs_computation/e7/1e7e/1e7e.fit
pddf	/app/data/pr_computation/e7/1e7e/1e7e.pr.out
profile	/app/data/saxs_computation/e7/1e7e/1e7e.dat

HUMAN SERUM ALBUMIN COMPLEXED WITH DECANOIC ACID (CAPRIC ACID)

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