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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GLPTCGETCTLGTCYVPDCSCSWPICMKN
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Chain assignments

Content subtype: combined_17531_2lam.nef

Assigned chemical shifts

1. Saveframe: assigned_chem_shift_list_1
   • Status: Warning
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 29, Sequence coverage: 100.0%

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   • Total number of assignments
     • ¹H chemical shifts: 162
   • Completeness of assignments
     • Entity_assemble_ID: A
       • Excluded Atom_ID in statistics

         Comp_index_ID	Comp_ID	Atom_ID	CS value (ppm)
         28	LYS	HZ1	7.634
         28	LYS	HZ2	7.634
         28	LYS	HZ3	7.634

       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	155	148	95.5

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	58	57	98.3

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	97	91	93.8

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         1H chemical shifts	13	11	84.6

       • Aromatic group atoms

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

   • 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: CNS/XPLOR_distance_constraints_2
   • Status: OK
   • Experiment type: noe
   • Sequence coverage of experimental data
     • Entity_assembly_ID: A, Chain length: 29, Sequence coverage: 100.0%

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   • Total number of restraints: 489
     • Intra-residue restraints, i = j : 104
     • Sequential restraints, | i - j | = 1 : 193
       • Backbone-backbone: 35
       • Backbone-side chain: 91
       • Side chain-side chain: 67
     • Medium range restraints, 1 < | i - j | < 5 : 56
       • Backbone-backbone: 11
       • Backbone-side chain: 31
       • Side chain-side chain: 14
     • Long range restraints, | i - j | >= 5 : 136
   • Weight of restraints: 1.0 (489)
     • Intra-residue restraints, i = j : 1.0 (104)
     • Sequential restraints, | i - j | = 1 : 1.0 (193)
       • Backbone-backbone: 1.0 (35)
       • Backbone-side chain: 1.0 (91)
       • Side chain-side chain: 1.0 (67)
     • Medium range restraints, 1 < | i - j | < 5 : 1.0 (56)
       • Backbone-backbone: 1.0 (11)
       • Backbone-side chain: 1.0 (31)
       • Side chain-side chain: 1.0 (14)
     • Long range restraints, | i - j | >= 5 : 1.0 (136)
   • Potential type of restraints: square-well-parabolic (489)
     • Intra-residue restraints, i = j : square-well-parabolic (104)
     • Sequential restraints, | i - j | = 1 : square-well-parabolic (193)
       • Backbone-backbone: square-well-parabolic (35)
       • Backbone-side chain: square-well-parabolic (91)
       • Side chain-side chain: square-well-parabolic (67)
     • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (56)
       • Backbone-backbone: square-well-parabolic (11)
       • Backbone-side chain: square-well-parabolic (31)
       • Side chain-side chain: square-well-parabolic (14)
     • Long range restraints, | i - j | >= 5 : square-well-parabolic (136)
   • Range of distance target values: 2.15, 3.65 (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
   • Saveframe: CNS/XPLOR_distance_constraints_3
     • Status: Warning
     • Experiment type: hbond
     • Sequence coverage of experimental data
       • Entity_assembly_ID: A, Chain length: 29, Sequence coverage: 6.9%
     • Total number of restraints: 2
       • Medium range restraints, 1 < | i - j | < 5 : 2
     • Weight of restraints: 1.0 (2)
       • Medium range restraints, 1 < | i - j | < 5 : 1.0 (2)
     • Potential type of restraints: square-well-parabolic (2)
       • Medium range restraints, 1 < | i - j | < 5 : square-well-parabolic (2)
     • Range of distance target values: 1.0, 1.5 (Å)
     • Histogram of distance target values
     • Distance restraints per residue
       • Chain_ID: A
     • Distance restraints on contact map