Mass: 7186.223 Da / Num. of mol.: 1 / Fragment: SRC HOMOLOGY 3 DOMAIN Mutation: CIRCULAR PERMUTANT, CUT AT S19-P20, INS(MG-P20), INS(SG-T4) Source method: isolated from a genetically manipulated source Details: THIS IS A CIRCULAR PERMUTANT OF THE WT ALPHA-SPECTRIN SH3 SEQUENCE (PDB ENTRY WT-3D STRUCTURE: 1SGB). THE RESIDUE NUMBERS ARE AS IN THE WT SPECTRIN-SH3 DOMAIN (1SGB). THR 4 (N-TERMINUS) AND ...Details: THIS IS A CIRCULAR PERMUTANT OF THE WT ALPHA-SPECTRIN SH3 SEQUENCE (PDB ENTRY WT-3D STRUCTURE: 1SGB). THE RESIDUE NUMBERS ARE AS IN THE WT SPECTRIN-SH3 DOMAIN (1SGB). THR 4 (N-TERMINUS) AND ASP 62 (C-TERMINUS) OF THE WT-SH3 SEQUENCE ARE LINKED BY TWO ADDITIONAL RESIDUES (SER 2, GLY 3). THE CHAIN IS CLEAVED BETWEEN SER 19 AND PRO 20. TWO RESIDUES ARE ADDED AT THE NEW N-TERMINUS (MET 100, GLY 101). Source: (gene. exp.) Gallus gallus (chicken) / Organ: BRAIN / Plasmid: PET3D / Production host: Escherichia coli (E. coli) / References: UniProt: P07751
Mass: 18.015 Da / Num. of mol.: 70 / Source method: isolated from a natural source / Formula: H2O
Sequence details
THIS IS A CIRCULAR PERMUTANT OF THE WT ALPHA-SPECTRIN SH3 SEQUENCE (PDB ENTRY WT-3D STRUCTURE: 1SGB) ...THIS IS A CIRCULAR PERMUTANT OF THE WT ALPHA-SPECTRIN SH3 SEQUENCE (PDB ENTRY WT-3D STRUCTURE: 1SGB). THE RESIDUE NUMBERS ARE AS IN THE WT SPECTRIN-SH3 DOMAIN (1SGB). THR 4 (N-TERMINUS) AND ASP 62 (C-TERMINUS) OF THE WT-SH3 SEQUENCE ARE LINKED BY TWO ADDITIONAL RESIDUES (SER 2, GLY 3). THE CHAIN IS CLEAVED BETWEEN SER 19 AND PRO 20. TWO RESIDUES ARE ADDED AT THE NEW N-TERMINUS (MET 100, GLY 101).
Resolution: 2.02→8 Å / σ(F): 1 Details: THE TWO C-TERMINAL RESIDUES (LYS 18, SER 19) ARE NOT VISIBLE IN THE ELECTRON DENSITY MAP. THERE IS NO SIDE CHAIN ELECTRON DENSITY FOR GLU 17.
Rfactor
Num. reflection
Rfree
0.29
-
Rwork
0.214
-
obs
0.214
5675
Displacement parameters
Biso mean: 29.88 Å2
Refinement step
Cycle: LAST / Resolution: 2.02→8 Å
Protein
Nucleic acid
Ligand
Solvent
Total
Num. atoms
484
0
0
70
554
Refine LS restraints
Refine-ID
Type
Dev ideal
X-RAY DIFFRACTION
x_bond_d
0.01
X-RAY DIFFRACTION
x_bond_d_na
X-RAY DIFFRACTION
x_bond_d_prot
X-RAY DIFFRACTION
x_angle_d
X-RAY DIFFRACTION
x_angle_d_na
X-RAY DIFFRACTION
x_angle_d_prot
X-RAY DIFFRACTION
x_angle_deg
1.577
X-RAY DIFFRACTION
x_angle_deg_na
X-RAY DIFFRACTION
x_angle_deg_prot
X-RAY DIFFRACTION
x_dihedral_angle_d
X-RAY DIFFRACTION
x_dihedral_angle_d_na
X-RAY DIFFRACTION
x_dihedral_angle_d_prot
X-RAY DIFFRACTION
x_improper_angle_d
1.262
X-RAY DIFFRACTION
x_improper_angle_d_na
X-RAY DIFFRACTION
x_improper_angle_d_prot
X-RAY DIFFRACTION
x_mcbond_it
X-RAY DIFFRACTION
x_mcangle_it
X-RAY DIFFRACTION
x_scbond_it
X-RAY DIFFRACTION
x_scangle_it
+
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