Properties

Disulfide bonds

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

Non-standard residues

Content subtype: bmr1358_3.str

Assigned chemical shifts

1. Saveframe: chemical_shift_assignment_data_set_one
   • Status: Warning
   • Sequence coverage of experimental data
     • Entity_assembly_ID: 1, Chain length: 19, Sequence coverage: 100.0%

     --------10---------
     KETAAAKFERQHMDSSTSA
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     KETAAAKFERQHMDSSTSA
     

   • Total number of assignments
     • ¹H chemical shifts: 32
   • Completeness of assignments
     • Entity_assemble_ID: 1
       • Excluded Atom_ID in statistics

         Comp_index_ID	Comp_ID	Atom_ID	CS value (ppm)
         1	LYS	HZ1	7.531
         1	LYS	HZ2	7.531
         1	LYS	HZ3	7.531
         7	LYS	HZ1	7.531
         7	LYS	HZ2	7.531
         7	LYS	HZ3	7.531
         10	ARG	HH11	6.709
         10	ARG	HH12	6.709
         10	ARG	HH21	6.709
         10	ARG	HH22	6.709
         12	HIS	HD1	8.578

       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	107	21	19.6

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	38	18	47.4

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	69	3	4.3

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	7	0	0.0

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	7	0	0.0

   • Histogram of normalized assigned chemical shifts
   • Random coil index and derived parameters (S² and NMR RMSD)
     • Chain_ID: 1