2vlq

F86A mutant of E9 DNase domain in complex with Im9

Method: X-RAY DIFFRACTION Dmax: 63.6 Å Quality: GOOD

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

COLICIN-E9 IMMUNITY PROTEIN

ESCHERICHIA COLI

UniProt P13479

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 × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain A; UniProt 1–86 Not recorded COLICIN E9 × 1 (P09883) MLA MALONIC ACID × 3 X-RAY DIFFRACTION X-ray crystallization conditions:2.9 M AMMONIUM SULPHATE AND 100 MM BIS-TRIS PH 5.5 Resolution 1.60 Å R-free 0.199

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.

19 other PDB entries and 27 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name IMM9_ECOLX
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–86; UniProt 1–86

COLICIN E9

ESCHERICHIA COLI

UniProt P09883

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 × 2 PDB declaration: dimeric(2) Consistent with protein copy count Chain B; UniProt 450–582 Fragment:DNASE DOMAIN, RESIDUES 450-582 Mutation:YES COLICIN-E9 IMMUNITY PROTEIN × 1 (P13479) MLA MALONIC ACID × 3 X-RAY DIFFRACTION X-ray crystallization conditions:2.9 M AMMONIUM SULPHATE AND 100 MM BIS-TRIS PH 5.5 Resolution 1.60 Å R-free 0.199

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.

24 other PDB entries and 42 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name CEA9_ECOLX
Isoform
PDB entities 2
Chains and sequence ranges Author chain B; PDBConstruct 2–134; UniProt 450–582

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 2vlq

P(r) Distance Distribution P(r) Distribution

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

Entry ID entry_id2vlq
Deposition date deposition_date2008-01-15
Structure title titleF86A mutant of E9 DNase domain in complex with Im9
Keywords keywords;PROTEIN-BINDING, PROTEIN-PROTEIN INTERACTION, METAL-BINDING, ANTIMICROBIAL, BACTERIOCIN IMMUNITY, HYDROLASE, ANTIBIOTIC, BACTERIOCIN, ENDONUCLEASE, ZINC, COLICIN, PLASMID, NUCLEASE, HTH MOTIF, PROTEIN BINDING ;; PROTEIN BINDING
Experimental Method methodX-RAY DIFFRACTION

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

Radius of gyration Rg (Guinier) rg_guinier19.58
Radius of gyration Rg (electron density) rg_electron18.75
Forward intensity I(0) i011691200.00
Molecular weight molecular_weight24431.0 kDa
Excluded volume excluded_volume30119 ų
Envelope volume envelope_volume35768 ų
Hydration-shell volume shell_volume16573 ų
Envelope diameter envelope_diameter62.8
Shell Rg shell_rg24.30
Envelope Rg envelope_rg19.05
Shape Rg shape_rg18.71
Total Rg total_rg19.68
Total atoms total_atoms1721
Residues n_residues218
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 dmax63.6
Rg (real space) rg_real19.60
Rg uncertainty (real space) rg_real_error0.39
I(0) (real space) i0_real1.1690e+07
I(0) uncertainty (real space) i0_real_error1.6510e+05
Rg (reciprocal space) rg_reciprocal19.60
I(0) (reciprocal space) i0_reciprocal11690000.0000
Solution quality estimate total_estimate0.8851
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks2
Primary peak position r_peak_primary21.5
Skewness Skewness skewness0.398
Kurtosis Kurtosis kurtosis-0.299
Angular range angular_range— – 0.4050 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha2120000.0000
Real-space data points n_real_points72
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.858; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.975; Smooth: 0.953

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_idd2vlqa_
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_idd2vlqb_
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_id2vlqA00
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_id2vlqB00
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)