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

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LYRRRFVVGR
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LYRRRFVVGR

Chain assignments

Content subtype: combined_25012_2mq5.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: Warning
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 10, Sequence coverage: 100.0%

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     LYRRRFVVGR
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     LYRRRFVVGR
     

   • Total number of assignments
     • ¹H chemical shifts: 46
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	73	45	61.6

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	21	20	95.2

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	52	25	48.1

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	6	4	66.7

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	9	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: DYANA/DIANA_distance_constraints_2
   • Status: Warning
   • Experiment type: noe
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 10, Sequence coverage: 100.0%

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     LYRRRFVVGR
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     LYRRRFVVGR
     

   • Total number of restraints: 117
     • Intra-residue restraints, i = j : 53
     • Sequential restraints, | i - j | = 1 : 42
       • Backbone-backbone: 16
       • Backbone-side chain: 18
       • Side chain-side chain: 8
     • Medium range restraints, 1 < | i - j | < 5 : 22
       • Backbone-backbone: 3
       • Backbone-side chain: 9
       • Side chain-side chain: 10
   • Weight of restraints: 1.0 (117)
     • Intra-residue restraints, i = j : 1.0 (53)
     • Sequential restraints, | i - j | = 1 : 1.0 (42)
       • Backbone-backbone: 1.0 (16)
       • Backbone-side chain: 1.0 (18)
       • Side chain-side chain: 1.0 (8)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (22)
       • Backbone-backbone: 1.0 (3)
       • Backbone-side chain: 1.0 (9)
       • Side chain-side chain: 1.0 (10)
   • Potential type of restraints: upper-bound-parabolic (117)
     • Intra-residue restraints, i = j : upper-bound-parabolic (53)
     • Sequential restraints, | i - j | = 1 : upper-bound-parabolic (42)
       • Backbone-backbone: upper-bound-parabolic (16)
       • Backbone-side chain: upper-bound-parabolic (18)
       • Side chain-side chain: upper-bound-parabolic (8)
     • Medium range restraints, 1 < | i - j | < 5 : upper-bound-parabolic (22)
       • Backbone-backbone: upper-bound-parabolic (3)
       • Backbone-side chain: upper-bound-parabolic (9)
       • Side chain-side chain: upper-bound-parabolic (10)
   • Range of distance target values: 2.8, 4.5 (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