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1b63

MUTL COMPLEXED WITH ADPNP

Method: X-RAY DIFFRACTION D_max: 73.5 Å Quality: GOOD

SAXS Profile

P(r) Distribution

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1. Structure Basics

entry_id	1b63
deposition_date	1999-01-20
title	MUTL COMPLEXED WITH ADPNP
keywords	DNA MISMATCH REPAIR, ATPASE; DNA MISMATCH REPAIR
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	22.14 Å
rg_electron	21.21 Å
i0	26105100.00
molecular_weight	37815.0 kDa
excluded_volume	46929 Å³
envelope_volume	57529 Å³
shell_volume	22603 Å³
envelope_diameter	75.1 Å
shell_rg	27.85 Å
envelope_rg	21.78 Å
shape_rg	21.23 Å
total_rg	22.00 Å
total_atoms	2658
n_residues	333
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	73.5 Å
rg_real	22.10 Å
rg_real_error	0.48 Å
i0_real	2.6110e+07
i0_real_error	3.5470e+05
rg_reciprocal	22.11 Å
i0_reciprocal	26110000.0000
total_estimate	0.8811
solution_quality	GOOD a GOOD solution
n_peaks	2
r_peak_primary	27.4 Å
skewness	0.331
kurtosis	-0.262
angular_range	— – 0.3600 Å⁻¹
current_alpha	0.0000
highest_alpha	5067000.0000
n_real_points	68
gnom_version	4.1.3
quality_criteria	AN1: 0.000; Oscil: 0.840; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.985; Smooth: 0.945

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4. Crystallography & Experiment

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5. Entities & Polymer Info (5)

Entity 1 polymer

description	MUTL
formula_weight	37215.3 kDa
src_method	man
entity_count	1

Polymer

type	polypeptide(L)
strand_id	A
atom_count	2943

SHMPIQVLPPQLANQIAAGEVVERPASVVKELVENSLDAGATRIDIDIERGGAKLIRIRDNGCGIKKDELALALARHATSKIASLDDLEAIISLGFRGEALASISSVSRLTLTSRTAEQQEAWQAYAEGRDMNVTVKPAAHPVGTTLEVLDLFYNTPARRKFLRTEKTEFNHIDEIIRRIALARFDVTINLSHNGKIVRQYRAVPEGGQKERRLGAICGTAFLEQALAIEWQHGDLTLRGWVADPNHTTPALAEIQYCYVNGRMMRDRLINHAIRQACEDKLGADQQPAFVLYLEIDPHQVDVNVHPAKHEVRFHQSRLVHDFIYQGVLSVLQ

Source

organism	Escherichia coli K12
ncbi_taxonomy_id	83333
host_organism	Escherichia coli

Entity 2 non-polymer

description	MAGNESIUM ION
formula_weight	24.3 kDa
src_method	syn
entity_count	1

Entity 3 non-polymer

description	1,2-ETHANEDIOL
formula_weight	62.1 kDa
src_method	syn
entity_count	2

Entity 4 non-polymer

description	PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
formula_weight	506.2 kDa
src_method	syn
entity_count	1

Entity 5 water

description	water
formula_weight	18.0 kDa
src_method	nat
entity_count	285

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6. Citations (1)

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length_a	62.190 Å
length_b	72.370 Å
length_c	189.930 Å
angle_alpha	90.00 °
angle_beta	90.00 °
angle_gamma	90.00 °
z_pdb	8

space_group	I 2 2 2
int_tables_number	23
crystal_system	—

resolution	1.900 Å
resolution_low	20.000 Å
r_factor	0.2130
r_work	0.2130
r_free	0.2610

fit	/app/data/saxs_computation/b6/1b63/1b63.fit
pddf	/app/data/pr_computation/b6/1b63/1b63.pr.out
profile	/app/data/saxs_computation/b6/1b63/1b63.dat