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----
GLNALKKVFQPIHEAIKLINNHVQ
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GLNALKKVFQPIHEAIKLINNHVQ

Chain assignments

Content subtype: combined_26040_2ncy.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: OK
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 24, Sequence coverage: 100.0%

     --------10--------20----
     GLNALKKVFQPIHEAIKLINNHVQ
     ||||||||||||||||||||||||
     GLNALKKVFQPIHEAIKLINNHVQ
     

   • Total number of assignments
     • ¹H chemical shifts: 134
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	159	134	84.3

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	48	47	97.9

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	111	87	78.4

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	18	15	83.3

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	9	4	44.4

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

Distance restraints

1. Saveframe: DYANA/DIANA_distance_constraints_2
   • Status: OK
   • Experiment type: noe
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 24, Sequence coverage: 100.0%

     --------10--------20----
     GLNALKKVFQPIHEAIKLINNHVQ
     ||||||||||||||||||||||||
     GLNALKKVFQPIHEAIKLINNHVQ
     

   • Total number of restraints: 306
     • Intra-residue restraints, i = j : 111
     • Sequential restraints, | i - j | = 1 : 96
       • Backbone-backbone: 15
       • Backbone-side chain: 68
       • Side chain-side chain: 13
     • Medium range restraints, 1 < | i - j | < 5 : 87
       • Backbone-backbone: 13
       • Backbone-side chain: 50
       • Side chain-side chain: 24
     • Long range restraints, | i - j | >= 5 : 12
   • Weight of restraints: 1.0 (306)
     • Intra-residue restraints, i = j : 1.0 (111)
     • Sequential restraints, | i - j | = 1 : 1.0 (96)
       • Backbone-backbone: 1.0 (15)
       • Backbone-side chain: 1.0 (68)
       • Side chain-side chain: 1.0 (13)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (87)
       • Backbone-backbone: 1.0 (13)
       • Backbone-side chain: 1.0 (50)
       • Side chain-side chain: 1.0 (24)
     • Long range restraints, | i - j | >= 5 : 1.0 (12)
   • Potential type of restraints: upper-bound-parabolic (306)
     • Intra-residue restraints, i = j : upper-bound-parabolic (111)
     • Sequential restraints, | i - j | = 1 : upper-bound-parabolic (96)
       • Backbone-backbone: upper-bound-parabolic (15)
       • Backbone-side chain: upper-bound-parabolic (68)
       • Side chain-side chain: upper-bound-parabolic (13)
     • Medium range restraints, 1 < | i - j | < 5 : upper-bound-parabolic (87)
       • Backbone-backbone: upper-bound-parabolic (13)
       • Backbone-side chain: upper-bound-parabolic (50)
       • Side chain-side chain: upper-bound-parabolic (24)
     • Long range restraints, | i - j | >= 5 : upper-bound-parabolic (12)
   • Range of distance target values: 2.73, 5.5 (Å)
   • Histogram of distance target values
   • Histogram of discrepancy in distance target values
   • Distance restraints per residue
     • Chain_ID: A
   • Distance restraints on contact map
     • Chain_ID_1: A - Chain_ID_2: A