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--------20---
GIGKFLHSAKKFGKAFVGEIMNS
|||||||||||||||||||||||
GIGKFLHSAKKFGKAFVGEIMNS

Chain assignments

Content subtype: combined_18420_2lsa.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: OK
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 23, Sequence coverage: 100.0%

     --------10--------20---
     GIGKFLHSAKKFGKAFVGEIMNS
     |||||||||||||||||||||||
     GIGKFLHSAKKFGKAFVGEIMNS
     

   • Total number of assignments
     • ¹H chemical shifts: 53
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	144	53	36.8

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	50	49	98.0

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	94	4	4.3

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	11	0	0.0

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	17	0	0.0

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

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: 23, Sequence coverage: 100.0%

     --------10--------20---
     GIGKFLHSAKKFGKAFVGEIMNS
     |||||||||||||||||||||||
     GIGKFLHSAKKFGKAFVGEIMNS
     

   • Total number of restraints: 104
     • Intra-residue restraints, i = j : 25
     • Sequential restraints, | i - j | = 1 : 37
       • Backbone-backbone: 37
     • Medium range restraints, 1 < | i - j | < 5 : 42
       • Backbone-backbone: 41
       • Backbone-side chain: 1
   • Weight of restraints: 1.0 (104)
     • Intra-residue restraints, i = j : 1.0 (25)
     • Sequential restraints, | i - j | = 1 : 1.0 (37)
       • Backbone-backbone: 1.0 (37)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (42)
       • Backbone-backbone: 1.0 (41)
       • Backbone-side chain: 1.0 (1)
   • Potential type of restraints: square-well-parabolic (104)
     • Intra-residue restraints, i = j : square-well-parabolic (25)
     • Sequential restraints, | i - j | = 1 : square-well-parabolic (37)
       • Backbone-backbone: square-well-parabolic (37)
     • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (42)
       • Backbone-backbone: square-well-parabolic (41)
       • Backbone-side chain: square-well-parabolic (1)
   • Range of distance target values: 2.17, 4.33 (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