Properties

Disulfide bonds

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

Non-standard residues

Content subtype: bmr4864_3.str

Assigned chemical shifts

1. Saveframe: chemical_shifts_OMTKY3_pH7.3
   • Status: OK
   • Sequence coverage of experimental data
     • Entity_assembly_ID: 1, Chain length: 56, Sequence coverage: 89.3%

     --------10--------20--------30--------40--------50------
     LAAVSVDCSEYPKPACTLEYRPLCGSDNKTYGNKCNFCNAVVESNGTLTLSHFGKC
           ||||||||||||||||||||||||||||||||||||||||||||||||||
     ......DCSEYPKPACTLEYRPLCGSDNKTYGNKCNFCNAVVESNGTLTLSHFGKC
     

   • Total number of assignments
     • ¹³C chemical shifts: 96
     • ¹H chemical shifts: 46
     • ¹⁵N chemical shifts: 46
   • Completeness of assignments
     • Entity_assemble_ID: 1
       • All atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         13C chemical shifts	238	96	40.3
         1H chemical shifts	313	46	14.7
         15N chemical shifts	59	46	78.0

       • Backbone atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         13C chemical shifts	112	96	85.7
         1H chemical shifts	113	46	40.7
         15N chemical shifts	53	46	86.8

       • Side chain atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         13C chemical shifts	126	0	0.0
         1H chemical shifts	200	0	0.0
         15N chemical shifts	6	0	0.0

       • Methyl group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         13C chemical shifts	26	0	0.0
         1H chemical shifts	26	0	0.0

       • Aromatic group atoms

         Atom group	# of target shifts	# of assigned shifts	Completeness (%)
         13C chemical shifts	24	0	0.0
         1H chemical shifts	24	0	0.0

   • Redox state of CYS
     • 1:8:CYS, CA: 51.72 ppm, CB: None ppm
       • Redox_state (pred. by CS): oxidized 87.1%, reduced 12.9%
     • 1:24:CYS, CA: 54.55 ppm, CB: None ppm
       • Redox_state (pred. by CS): oxidized 78.2%, reduced 21.8%
     • 1:35:CYS, CA: 58.68 ppm, CB: None ppm
       • Redox_state (pred. by CS): oxidized 36.7%, reduced 63.3%
     • 1:38:CYS, CA: 55.64 ppm, CB: None ppm
       • Redox_state (pred. by CS): oxidized 71.1%, reduced 28.9%
   • Histogram of normalized assigned chemical shifts
   • Random coil index and derived parameters (S² and NMR RMSD)
     • Chain_ID: 1