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---
FEDLPNFGHIQVKVFNHGEHIHH
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FEDLPNFGHIQVKVFNHGEHIHH

Chain assignments

Content subtype: combined_25555_2n1c.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---
     FEDLPNFGHIQVKVFNHGEHIHH
     |||||||||||||||||||||||
     FEDLPNFGHIQVKVFNHGEHIHH
     

   • Total number of assignments
     • ¹H chemical shifts: 140
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	147	140	95.2

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	47	46	97.9

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	100	94	94.0

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	10	10	100.0

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	25	19	76.0

   • 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---
     FEDLPNFGHIQVKVFNHGEHIHH
     |||||||||||||||||||||||
     FEDLPNFGHIQVKVFNHGEHIHH
     

   • Total number of restraints: 363
     • Intra-residue restraints, i = j : 215
     • Sequential restraints, | i - j | = 1 : 107
       • Backbone-backbone: 31
       • Backbone-side chain: 68
       • Side chain-side chain: 8
     • Medium range restraints, 1 < | i - j | < 5 : 41
       • Backbone-backbone: 13
       • Backbone-side chain: 20
       • Side chain-side chain: 8
   • Weight of restraints: 1.0 (363)
     • Intra-residue restraints, i = j : 1.0 (215)
     • Sequential restraints, | i - j | = 1 : 1.0 (107)
       • Backbone-backbone: 1.0 (31)
       • Backbone-side chain: 1.0 (68)
       • Side chain-side chain: 1.0 (8)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (41)
       • Backbone-backbone: 1.0 (13)
       • Backbone-side chain: 1.0 (20)
       • Side chain-side chain: 1.0 (8)
   • Potential type of restraints: square-well-parabolic (363)
     • Intra-residue restraints, i = j : square-well-parabolic (215)
     • Sequential restraints, | i - j | = 1 : square-well-parabolic (107)
       • Backbone-backbone: square-well-parabolic (31)
       • Backbone-side chain: square-well-parabolic (68)
       • Side chain-side chain: square-well-parabolic (8)
     • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (41)
       • Backbone-backbone: square-well-parabolic (13)
       • Backbone-side chain: square-well-parabolic (20)
       • Side chain-side chain: square-well-parabolic (8)
   • Range of distance target values: 2.15, 3.15 (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
   • Saveframe: CNS/XPLOR_distance_constraints_3
     • Status: OK
     • Experiment type: noe
     • Sequence coverage of experimental data
       • Entity_assembly_ID: A, Chain length: 23, Sequence coverage: 30.4%
     • Total number of restraints: 8
       • Intra-residue restraints, i = j : 1
       • Sequential restraints, | i - j | = 1 : 2
         • Backbone-side chain: 2
       • Medium range restraints, 1 < | i - j | < 5 : 5
         • Backbone-side chain: 5
     • Weight of restraints: 1.0 (8)
       • Intra-residue restraints, i = j : 1.0 (1)
       • Sequential restraints, | i - j | = 1 : 1.0 (2)
         • Backbone-side chain: 1.0 (2)
       • Medium range restraints, 1 < | i - j | < 5 : 1.0 (5)
         • Backbone-side chain: 1.0 (5)
     • Potential type of restraints: square-well-parabolic (8)
       • Intra-residue restraints, i = j : square-well-parabolic (1)
       • Sequential restraints, | i - j | = 1 : square-well-parabolic (2)
         • Backbone-side chain: square-well-parabolic (2)
       • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (5)
         • Backbone-side chain: square-well-parabolic (5)
     • Range of distance target values: 2.65, 3.15 (Å)
     • Histogram of distance target values
     • Distance restraints per residue
       • Chain_ID: A
     • Distance restraints on contact map