7bve

Cryo-EM structure of Mycobacterium smegmatis arabinosyltransferase EmbC2-AcpM2 in complex with ethambutol

Method: ELECTRON MICROSCOPY Dmax: 143.1 Å Quality: GOOD

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

Integral membrane indolylacetylinositol arabinosyltransferase EmbC

Mycolicibacterium smegmatis (strain ATCC 700084 / mc(2)155)

UniProt I7FMU5

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 × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain A; UniProt 1–1074 Chain B; UniProt 1–1074 Not recorded Meromycolate extension acyl carrier protein × 2 (A0R0B3) CA CALCIUM ION × 2 PO4 PHOSPHATE ION × 2 95E Ethambutol × 2 PN7 N~3~-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide × 2 ELECTRON MICROSCOPY cryo-EM buffer:pH 7.4 cryo-EM vitrification conditions:Cryogen ETHANE Resolution 2.81 Å

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.

1 other PDB entries and 1 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name I7FMU5_MYCS2
Isoform
PDB entities 1
Chains and sequence ranges Author chain A; PDBConstruct 1–1074; UniProt 1–1074 Author chain B; PDBConstruct 1–1074; UniProt 1–1074

Meromycolate extension acyl carrier protein

OrganismNot specified

UniProt A0R0B3

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 × 4 PDB declaration: tetrameric(4) Consistent with protein copy count Chain C; UniProt 1–99 Chain D; UniProt 1–99 Not recorded Integral membrane indolylacetylinositol arabinosyltransferase EmbC × 2 (I7FMU5) CA CALCIUM ION × 2 PO4 PHOSPHATE ION × 2 95E Ethambutol × 2 PN7 N~3~-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-N-(2-sulfanylethyl)-beta-alaninamide × 2 ELECTRON MICROSCOPY cryo-EM buffer:pH 7.4 cryo-EM vitrification conditions:Cryogen ETHANE Resolution 2.81 Å

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.

18 other PDB entries and 18 assemblies. Open the comparison page and filter oligomeric states

View Construct and Data Evidence
UniProt name ACPM_MYCS2
Isoform
PDB entities 2
Chains and sequence ranges Author chain C; PDBConstruct 1–99; UniProt 1–99 Author chain D; PDBConstruct 1–99; UniProt 1–99

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 7bve

P(r) Distance Distribution P(r) Distribution

P(r) distribution for 7bve
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2. Structure Basics 2. Structure Basics

Entry ID entry_id7bve
Deposition date deposition_date2020-04-10
Structure title titleCryo-EM structure of Mycobacterium smegmatis arabinosyltransferase EmbC2-AcpM2 in complex with ethambutol
Keywords keywords;Mycobacterium smegmatis, cell wall synthesis, drug target, ethambutol, arabinosyltransferase, EmbC, acyl carrier protein, arabinogalactan, lipoarabinomannan, drug resistance, TRANSFERASE ;; TRANSFERASE
Experimental Method methodELECTRON MICROSCOPY

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

Radius of gyration Rg (Guinier) rg_guinier44.77
Radius of gyration Rg (electron density) rg_electron43.74
Forward intensity I(0) i0807414000.00
Molecular weight molecular_weight242800.0 kDa
Excluded volume excluded_volume307330 ų
Envelope volume envelope_volume441180 ų
Hydration-shell volume shell_volume81276 ų
Envelope diameter envelope_diameter145.0
Shell Rg shell_rg51.10
Envelope Rg envelope_rg42.95
Shape Rg shape_rg43.71
Total Rg total_rg44.20
Total atoms total_atoms17146
Residues n_residues2236
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 dmax143.1
Rg (real space) rg_real44.53
Rg uncertainty (real space) rg_real_error1.55
I(0) (real space) i0_real8.0740e+08
I(0) uncertainty (real space) i0_real_error1.5130e+07
Rg (reciprocal space) rg_reciprocal44.77
I(0) (reciprocal space) i0_reciprocal807600000.0000
Solution quality estimate total_estimate0.8892
Solution quality rating solution_quality GOOD a GOOD solution
P(r) peaks n_peaks1
Primary peak position r_peak_primary57.2
Skewness Skewness skewness0.131
Kurtosis Kurtosis kurtosis-0.442
Angular range angular_range— – 0.1750 −1
Current regularization parameter α current_alpha0.0000
Highest regularization parameter α highest_alpha67940000.0000
Real-space data points n_real_points36
GNOM version gnom_version4.1.3
Quality Criteria quality_criteria AN1: 0.000; Oscil: 0.889; Stabil: 1.000; Sysdev: 1.000; Positv: 1.000; Valcen: 0.987; Smooth: 0.901

5. Crystallography and Experiment 5. Crystallography & Experiment

6. Entities and Polymers Entities & Polymers (6)

7. Fold Classification (SCOP + CATH) 4 domains

SCOP 2.08 (2 domains)

Domain ID domain_idd7bvec_
Class classa — All alpha proteins
Fold Fold folda.28 — Acyl carrier protein-like
Superfamily Superfamily superfamilya.28.1 — ACP-like
Family Family familya.28.1.0 — automated matches
Domain ID domain_idd7bved_
Class classa — All alpha proteins
Fold Fold folda.28 — Acyl carrier protein-like
Superfamily Superfamily superfamilya.28.1 — ACP-like
Family Family familya.28.1.0 — automated matches

CATH v4.4 (2 domains)

Domain ID domain_id7bveA01
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology120 — Jelly Rolls
Homologous superfamily homologous superfamily610 — arabinofuranosyltransferase like domain
Domain ID domain_id7bveB01
Class class2 — Mainly Beta
Architecture architecture60 — Sandwich
Topology topology120 — Jelly Rolls
Homologous superfamily homologous superfamily610 — arabinofuranosyltransferase like domain

8. Citations (1)

9. Files and Curves (10)