2jb0

CRYSTAL STRUCTURE OF THE MUTANT H573A OF THE NUCLEASE DOMAIN OF COLE7 IN COMPLEX WITH IM7

Method: X-RAY DIFFRACTION Dmax: 66.7 Å Quality: GOOD

1. Protein Identity and Related Structures Protein Identity & Related Structures

COLICIN E7 IMMUNITY PROTEIN

ESCHERICHIA COLI

UniProt Q03708

State in the Current Structure

Assembly Oligomeric State Construct Mutations and Modifications Ligands, Ions and Associated Components Method and Experimental Conditions Structure Quality
1 Protein heterocomplex Heteromer Protein × 8 PDB declaration: octameric(8) Consistent with protein copy count Chain A; UniProt 1–87 Not recorded COLICIN E7 × 4 (Q47112) ZN ZINC ION × 4 X-RAY DIFFRACTION X-ray crystallization conditions:pH 7;20 % W/V PEG3350 AND 0.2 M DI-AMMONIUM HYDROGEN CITRATE, pH 7.00 Resolution 1.91 Å R-free 0.250

Other States of the Same Protein in the Database

Each row is a biological assembly of the same UniProt protein in another PDB entry. The “Difference from current entry” column identifies evidence-level differences; no tag means the currently parsed fields agree.

13 other PDB entries and 16 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name IMM7_ECOLI
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–87; UniProt 1–87

COLICIN E7

ESCHERICHIA COLI

UniProt Q47112

State in the Current Structure

Assembly Oligomeric State Construct Mutations and Modifications Ligands, Ions and Associated Components Method and Experimental Conditions Structure Quality
1 Protein heterocomplex Heteromer Protein × 8 PDB declaration: octameric(8) Consistent with protein copy count Chain B; UniProt 446–576 Fragment:NUCLEASE DOMAIN, RESIDUES 446-576 Mutation:YES COLICIN E7 IMMUNITY PROTEIN × 4 (Q03708) ZN ZINC ION × 4 X-RAY DIFFRACTION X-ray crystallization conditions:pH 7;20 % W/V PEG3350 AND 0.2 M DI-AMMONIUM HYDROGEN CITRATE, pH 7.00 Resolution 1.91 Å R-free 0.250

Other States of the Same Protein in the Database

Each row is a biological assembly of the same UniProt protein in another PDB entry. The “Difference from current entry” column identifies evidence-level differences; no tag means the currently parsed fields agree.

16 other PDB entries and 22 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name CEA7_ECOLI
Isoform
PDB entities 2
Chains and sequence ranges Author chain B; PDBConstruct 1–131; UniProt 446–576

The page prioritizes protein identity, the current assembly, associated components, oligomeric state and cross-PDB links. Chain mapping and sequence ranges are retained as data evidence. Internal IDs, import timestamps and assembly operation expressions are maintenance fields and are not shown here.

SAXS scattering curve SAXS Profile

SAXS profile for 2jb0

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 2jb0
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2. Structure Basics 2. Structure Basics

Entry ID entry_id2jb0
Deposition date deposition_date2006-12-01
Structure title titleCRYSTAL STRUCTURE OF THE MUTANT H573A OF THE NUCLEASE DOMAIN OF COLE7 IN COMPLEX WITH IM7
Keywords keywords;HYDROLASE/INHIBITOR, HYDROLASE-INHIBITOR COMPLEX, ZINC, TOXIN, PLASMID, NUCLEASE, HYDROLASE, ANTIBIOTIC, H-N-H MOTIF, BACTERIOCIN, ENDONUCLEASE, METAL-BINDING, ANTIMICROBIAL, DNA HYDROLYSIS, BACTERIOCIN IMMUNITY, HIS METAL FINGER MOTIF ;; HYDROLASE/INHIBITOR
Experimental Method methodX-RAY DIFFRACTION

3. SAXS Parameters (CRYSOL theoretical calculation) 3. SAXS Parameters (CRYSOL)

Radius of gyration Rg (Guinier) rg_guinier19.35
Radius of gyration Rg (electron density) rg_electron18.67
Forward intensity I(0) i010493800.00
Molecular weight molecular_weight23533.0 kDa
Excluded volume excluded_volume29311 ų
Envelope volume envelope_volume34878 ų
Hydration-shell volume shell_volume16378 ų
Envelope diameter envelope_diameter66.3
Shell Rg shell_rg23.88
Envelope Rg envelope_rg18.95
Shape Rg shape_rg18.63
Total Rg total_rg19.60
Total atoms total_atoms1658
Residues n_residues207
Spherical-harmonic order n_harmonics20
q range q_range— – 0.5000 −1
Data points n_points101
Shell type shell_typedirectional
Solvent electron density solvent_density0.3340 e/ų
Shell contrast contrast_shell0.0300 e/ų
CRYSOL version crysol_version4.1.3

4. P(r) Distance Distribution (GNOM inversion) 4. P(r) Analysis (GNOM)

Maximum dimension Dmax dmax66.7
Rg (real space) rg_real19.42
Rg uncertainty (real space) rg_real_error0.51
I(0) (real space) i0_real1.0490e+07
I(0) uncertainty (real space) i0_real_error1.4240e+05
Rg (reciprocal space) rg_reciprocal19.41
I(0) (reciprocal space) i0_reciprocal10490000.0000
Solution quality estimate total_estimate0.7733
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks2
Primary peak position r_peak_primary21.6
Skewness Skewness skewness0.490
Kurtosis Kurtosis kurtosis-0.103
Angular range angular_range— – 0.4100 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha2214000.0000
Real-space data points n_real_points72
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.708; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.925; Smooth: 0.000

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (4)

7. Fold Classification (SCOP + CATH) 4 domains

SCOP 2.08 (2 domains)

Domain ID domain_idd2jb0a_
Class classa — All alpha proteins
Fold Fold folda.28 — Acyl carrier protein-like
Superfamily Superfamily superfamilya.28.2 — Colicin E immunity proteins
Family Family familya.28.2.1 — Colicin E immunity proteins
Domain ID domain_idd2jb0b_
Class classd — Alpha and beta proteins (a+b)
Fold Fold foldd.4 — His-Me finger endonucleases
Superfamily Superfamily superfamilyd.4.1 — His-Me finger endonucleases
Family Family familyd.4.1.1 — HNH-motif

CATH v4.4 (2 domains)

Domain ID domain_id2jb0A00
Class class1 — Mainly Alpha
Architecture architecture10 — Orthogonal Bundle
Topology topology1200 — Non-ribosomal Peptide Synthetase Peptidyl Carrier Protein; Chain A
Homologous superfamily homologous superfamily20 — Colicin E immunity protein
Domain ID domain_id2jb0B00
Class class3 — Alpha Beta
Architecture architecture90 — Alpha-Beta Complex
Topology topology540 — Colicin E7 immunity protein; Chain B, fragment: Endonuclease domain
Homologous superfamily homologous superfamily10 — Colicin/pyocin, DNase domain

8. Citations (1)

9. Files and Curves (10)