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---------
GAFVGQPEAVNPLGREIQG
|||||||||||||||||||
GAFVGQPEAVNPLGREIQG

Chain assignments

Content subtype: combined_18661_2lx6.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: Warning
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 19, Sequence coverage: 100.0%

     --------10---------
     GAFVGQPEAVNPLGREIQG
     |||||||||||||||||||
     GAFVGQPEAVNPLGREIQG
     

   • Total number of assignments
     • ¹H chemical shifts: 103
   • Completeness of assignments
     • Entity_assemble_ID: A
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	108	102	94.4

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	40	39	97.5

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	68	63	92.6

       • 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	5	0	0.0

   • 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: DYANA/DIANA_distance_constraints_2
   • Status: Warning
   • Experiment type: noe
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 19, Sequence coverage: 100.0%

     --------10---------
     GAFVGQPEAVNPLGREIQG
     |||||||||||||||||||
     GAFVGQPEAVNPLGREIQG
     

   • Total number of restraints: 155
     • Intra-residue restraints, i = j : 83
     • Sequential restraints, | i - j | = 1 : 39
       • Backbone-backbone: 17
       • Backbone-side chain: 21
     • Medium range restraints, 1 < | i - j | < 5 : 8
       • Backbone-backbone: 1
       • Backbone-side chain: 7
     • Long range restraints, | i - j | >= 5 : 23
     • Total hydrogen bond restraints: 2
   • Weight of restraints: 1.0 (155)
     • Intra-residue restraints, i = j : 1.0 (83)
     • Sequential restraints, | i - j | = 1 : 1.0 (39)
       • Backbone-backbone: 1.0 (17)
       • Backbone-side chain: 1.0 (21)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (8)
       • Backbone-backbone: 1.0 (1)
       • Backbone-side chain: 1.0 (7)
     • Long range restraints, | i - j | >= 5 : 1.0 (23)
     • Total hydrogen bond restraints: 1.0 (2)
   • Potential type of restraints: upper-bound-parabolic (155)
     • Intra-residue restraints, i = j : upper-bound-parabolic (83)
     • Sequential restraints, | i - j | = 1 : upper-bound-parabolic (39)
       • Backbone-backbone: upper-bound-parabolic (17)
       • Backbone-side chain: upper-bound-parabolic (21)
     • Medium range restraints, 1 < | i - j | < 5 : upper-bound-parabolic (8)
       • Backbone-backbone: upper-bound-parabolic (1)
       • Backbone-side chain: upper-bound-parabolic (7)
     • Long range restraints, | i - j | >= 5 : upper-bound-parabolic (23)
     • Total hydrogen bond restraints: upper-bound-parabolic (2)
   • Range of distance target values: 1.33, 5.0 (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

Dihedral angle restraints

1. Saveframe: DYANA/DIANA_dihedral_3
   • Status: OK
   • Experiment type: .
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 19, Sequence coverage: 100.0%

     --------10---------
     GAFVGQPEAVNPLGREIQG
     |||||||||||||||||||
     GAFVGQPEAVNPLGREIQG
     

   • Total number of restraints: 32
     • Phi angle constraints: 16
     • Chi1 angle constraints: 10
     • Chi2 angle constraints: 3
     • Psi angle constraints: 2
     • Chi3 angle constraints: 1
   • Total number of restraints per polymer type: 32
     • Protein: 32
   • Weight of restraints: 1.0 (32)
     • Phi angle constraints: 1.0 (16)
     • Chi1 angle constraints: 1.0 (10)
     • Chi2 angle constraints: 1.0 (3)
     • Psi angle constraints: 1.0 (2)
     • Chi3 angle constraints: 1.0 (1)
   • Potential type of restraints: square-well-parabolic (32)
     • Phi angle constraints: square-well-parabolic (16)
     • Chi1 angle constraints: square-well-parabolic (10)
     • Chi2 angle constraints: square-well-parabolic (3)
     • Psi angle constraints: square-well-parabolic (2)
     • Chi3 angle constraints: square-well-parabolic (1)
   • Plot of Phi-Psi angle restraints
   • Plot of Chi1-Chi2 angle restraints
   • Dihedral angle restraints per residue
     • Chain_ID: A