Properties

Disulfide bonds

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

Non-standard residues

Sequence alignments

• Entity_assembly_ID (NMR): A vs Auth_asym_ID (model): A

--------10-
XVLVNEILNHX
|||||||||||
XVLVNEILNHX

Chain assignments

Content subtype: combined_19580_2mg0.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: Warning
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 11, Sequence coverage: 100.0%

     --------10-
     XVLVNEILNHX
     |||||||||||
     XVLVNEILNHX
     

   • Total number of assignments
     • ¹H chemical shifts: 58
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	59	59	100.0

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	19	19	100.0

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	40	40	100.0

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	11	11	100.0

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	2	2	100.0

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

Covalent bonds

1. Saveframe: assembly
   • Status: OK

Distance restraints

1. Saveframe: CNS/XPLOR_distance_constraints_2
   • Status: OK
   • Experiment type: noe
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 11, Sequence coverage: 81.8%

     --------10-
     XVLVNEILNHX
      ||||||||| 
     .VLVNEILNH 
     --------10 
     

   • Total number of restraints: 74
     • Intra-residue restraints, i = j : 36
     • Sequential restraints, | i - j | = 1 : 20
       • Backbone-backbone: 12
       • Backbone-side chain: 8
     • Medium range restraints, 1 < | i - j | < 5 : 18
       • Backbone-backbone: 12
       • Backbone-side chain: 6
   • Weight of restraints: 1.0 (74)
     • Intra-residue restraints, i = j : 1.0 (36)
     • Sequential restraints, | i - j | = 1 : 1.0 (20)
       • Backbone-backbone: 1.0 (12)
       • Backbone-side chain: 1.0 (8)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (18)
       • Backbone-backbone: 1.0 (12)
       • Backbone-side chain: 1.0 (6)
   • Potential type of restraints: square-well-parabolic (74)
     • Intra-residue restraints, i = j : square-well-parabolic (36)
     • Sequential restraints, | i - j | = 1 : square-well-parabolic (20)
       • Backbone-backbone: square-well-parabolic (12)
       • Backbone-side chain: square-well-parabolic (8)
     • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (18)
       • Backbone-backbone: square-well-parabolic (12)
       • Backbone-side chain: square-well-parabolic (6)
   • Range of distance target values: 1.76, 3.14 (Å)
   • Histogram of distance target values
   • Distance restraints per residue
     • Chain_ID: A
   • Distance restraints on contact map
     • Chain_ID_1: A - Chain_ID_2: A