################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53241 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'DNAJA1 JD T5D T6D Y7D Y8D' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 53241 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53241 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 LYS H H 1 8.357 . . 1 . . . . . 3 LYS H . 53241 1 2 . 1 . 1 3 3 LYS N N 15 126.488 . . 1 . . . . . 3 LYS N . 53241 1 3 . 1 . 1 4 4 GLU H H 1 8.501 . . 1 . . . . . 4 GLU H . 53241 1 4 . 1 . 1 4 4 GLU N N 15 123.867 . . 1 . . . . . 4 GLU N . 53241 1 5 . 1 . 1 5 5 ASP H H 1 8.22 . . 1 . . . . . 5 ASP H . 53241 1 6 . 1 . 1 5 5 ASP N N 15 121.223 . . 1 . . . . . 5 ASP N . 53241 1 7 . 1 . 1 7 7 ASP H H 1 8.166 . . 1 . . . . . 7 ASP H . 53241 1 8 . 1 . 1 7 7 ASP N N 15 121.223 . . 1 . . . . . 7 ASP N . 53241 1 9 . 1 . 1 8 8 ASP H H 1 8.152 . . 1 . . . . . 8 ASP H . 53241 1 10 . 1 . 1 8 8 ASP N N 15 121.374 . . 1 . . . . . 8 ASP N . 53241 1 11 . 1 . 1 9 9 ASP H H 1 8.084 . . 1 . . . . . 9 ASP H . 53241 1 12 . 1 . 1 9 9 ASP N N 15 117.205 . . 1 . . . . . 9 ASP N . 53241 1 13 . 1 . 1 10 10 VAL H H 1 7.872 . . 1 . . . . . 10 VAL H . 53241 1 14 . 1 . 1 10 10 VAL N N 15 120.45 . . 1 . . . . . 10 VAL N . 53241 1 15 . 1 . 1 12 12 GLY H H 1 8.036 . . 1 . . . . . 12 GLY H . 53241 1 16 . 1 . 1 12 12 GLY N N 15 109.361 . . 1 . . . . . 12 GLY N . 53241 1 17 . 1 . 1 13 13 VAL H H 1 7.742 . . 1 . . . . . 13 VAL H . 53241 1 18 . 1 . 1 13 13 VAL N N 15 119.225 . . 1 . . . . . 13 VAL N . 53241 1 19 . 1 . 1 14 14 LYS H H 1 8.289 . . 1 . . . . . 14 LYS H . 53241 1 20 . 1 . 1 14 14 LYS N N 15 126.961 . . 1 . . . . . 14 LYS N . 53241 1 21 . 1 . 1 16 16 ASN H H 1 8.323 . . 1 . . . . . 16 ASN H . 53241 1 22 . 1 . 1 16 16 ASN N N 15 118.15 . . 1 . . . . . 16 ASN N . 53241 1 23 . 1 . 1 17 17 ALA H H 1 7.878 . . 1 . . . . . 17 ALA H . 53241 1 24 . 1 . 1 17 17 ALA N N 15 124.404 . . 1 . . . . . 17 ALA N . 53241 1 25 . 1 . 1 18 18 THR H H 1 8.193 . . 1 . . . . . 18 THR H . 53241 1 26 . 1 . 1 18 18 THR N N 15 113.423 . . 1 . . . . . 18 THR N . 53241 1 27 . 1 . 1 19 19 GLN H H 1 8.473 . . 1 . . . . . 19 GLN H . 53241 1 28 . 1 . 1 19 19 GLN N N 15 121.374 . . 1 . . . . . 19 GLN N . 53241 1 29 . 1 . 1 20 20 GLU H H 1 8.302 . . 1 . . . . . 20 GLU H . 53241 1 30 . 1 . 1 20 20 GLU N N 15 120.385 . . 1 . . . . . 20 GLU N . 53241 1 31 . 1 . 1 21 21 GLU H H 1 7.899 . . 1 . . . . . 21 GLU H . 53241 1 32 . 1 . 1 21 21 GLU N N 15 120.987 . . 1 . . . . . 21 GLU N . 53241 1 33 . 1 . 1 22 22 LEU H H 1 8.029 . . 1 . . . . . 22 LEU H . 53241 1 34 . 1 . 1 22 22 LEU N N 15 122.126 . . 1 . . . . . 22 LEU N . 53241 1 35 . 1 . 1 23 23 LYS H H 1 7.899 . . 1 . . . . . 23 LYS H . 53241 1 36 . 1 . 1 23 23 LYS N N 15 119.977 . . 1 . . . . . 23 LYS N . 53241 1 37 . 1 . 1 24 24 LYS H H 1 7.707 . . 1 . . . . . 24 LYS H . 53241 1 38 . 1 . 1 24 24 LYS N N 15 120.127 . . 1 . . . . . 24 LYS N . 53241 1 39 . 1 . 1 25 25 ALA H H 1 7.824 . . 1 . . . . . 25 ALA H . 53241 1 40 . 1 . 1 25 25 ALA N N 15 123.372 . . 1 . . . . . 25 ALA N . 53241 1 41 . 1 . 1 26 26 TYR H H 1 8.063 . . 1 . . . . . 26 TYR H . 53241 1 42 . 1 . 1 26 26 TYR N N 15 119.182 . . 1 . . . . . 26 TYR N . 53241 1 43 . 1 . 1 27 27 ARG H H 1 7.872 . . 1 . . . . . 27 ARG H . 53241 1 44 . 1 . 1 27 27 ARG N N 15 121.438 . . 1 . . . . . 27 ARG N . 53241 1 45 . 1 . 1 29 29 LEU H H 1 7.776 . . 1 . . . . . 29 LEU H . 53241 1 46 . 1 . 1 29 29 LEU N N 15 121.975 . . 1 . . . . . 29 LEU N . 53241 1 47 . 1 . 1 30 30 ALA H H 1 7.974 . . 1 . . . . . 30 ALA H . 53241 1 48 . 1 . 1 30 30 ALA N N 15 123.501 . . 1 . . . . . 30 ALA N . 53241 1 49 . 1 . 1 31 31 LEU H H 1 7.701 . . 1 . . . . . 31 LEU H . 53241 1 50 . 1 . 1 31 31 LEU N N 15 119.977 . . 1 . . . . . 31 LEU N . 53241 1 51 . 1 . 1 33 33 TYR H H 1 8.248 . . 1 . . . . . 33 TYR H . 53241 1 52 . 1 . 1 33 33 TYR N N 15 121.245 . . 1 . . . . . 33 TYR N . 53241 1 53 . 1 . 1 34 34 HIS H H 1 7.803 . . 1 . . . . . 34 HIS H . 53241 1 54 . 1 . 1 34 34 HIS N N 15 120.45 . . 1 . . . . . 34 HIS N . 53241 1 55 . 1 . 1 37 37 LYS H H 1 7.974 . . 1 . . . . . 37 LYS H . 53241 1 56 . 1 . 1 37 37 LYS N N 15 121.202 . . 1 . . . . . 37 LYS N . 53241 1 57 . 1 . 1 38 38 ASN H H 1 8.371 . . 1 . . . . . 38 ASN H . 53241 1 58 . 1 . 1 38 38 ASN N N 15 121.675 . . 1 . . . . . 38 ASN N . 53241 1 59 . 1 . 1 40 40 ASN H H 1 8.282 . . 1 . . . . . 40 ASN H . 53241 1 60 . 1 . 1 40 40 ASN N N 15 118.193 . . 1 . . . . . 40 ASN N . 53241 1 61 . 1 . 1 41 41 GLU H H 1 7.995 . . 1 . . . . . 41 GLU H . 53241 1 62 . 1 . 1 41 41 GLU N N 15 121.61 . . 1 . . . . . 41 GLU N . 53241 1 63 . 1 . 1 42 42 GLY H H 1 8.261 . . 1 . . . . . 42 GLY H . 53241 1 64 . 1 . 1 42 42 GLY N N 15 109.77 . . 1 . . . . . 42 GLY N . 53241 1 65 . 1 . 1 43 43 GLU H H 1 8.077 . . 1 . . . . . 43 GLU H . 53241 1 66 . 1 . 1 43 43 GLU N N 15 121.395 . . 1 . . . . . 43 GLU N . 53241 1 67 . 1 . 1 44 44 LYS H H 1 8.063 . . 1 . . . . . 44 LYS H . 53241 1 68 . 1 . 1 44 44 LYS N N 15 121.804 . . 1 . . . . . 44 LYS N . 53241 1 69 . 1 . 1 45 45 PHE H H 1 7.954 . . 1 . . . . . 45 PHE H . 53241 1 70 . 1 . 1 45 45 PHE N N 15 120.127 . . 1 . . . . . 45 PHE N . 53241 1 71 . 1 . 1 49 49 SER H H 1 8.152 . . 1 . . . . . 49 SER H . 53241 1 72 . 1 . 1 49 49 SER N N 15 119.397 . . 1 . . . . . 49 SER N . 53241 1 73 . 1 . 1 50 50 GLN H H 1 8.193 . . 1 . . . . . 50 GLN H . 53241 1 74 . 1 . 1 50 50 GLN N N 15 122.835 . . 1 . . . . . 50 GLN N . 53241 1 75 . 1 . 1 51 51 ALA H H 1 8.008 . . 1 . . . . . 51 ALA H . 53241 1 76 . 1 . 1 51 51 ALA N N 15 124.662 . . 1 . . . . . 51 ALA N . 53241 1 77 . 1 . 1 52 52 TYR H H 1 7.851 . . 1 . . . . . 52 TYR H . 53241 1 78 . 1 . 1 52 52 TYR N N 15 119.118 . . 1 . . . . . 52 TYR N . 53241 1 79 . 1 . 1 54 54 VAL H H 1 7.885 . . 1 . . . . . 54 VAL H . 53241 1 80 . 1 . 1 54 54 VAL N N 15 121.073 . . 1 . . . . . 54 VAL N . 53241 1 81 . 1 . 1 57 57 ASP H H 1 8.275 . . 1 . . . . . 57 ASP H . 53241 1 82 . 1 . 1 57 57 ASP N N 15 122.857 . . 1 . . . . . 57 ASP N . 53241 1 83 . 1 . 1 59 59 LYS H H 1 7.885 . . 1 . . . . . 59 LYS H . 53241 1 84 . 1 . 1 59 59 LYS N N 15 119.612 . . 1 . . . . . 59 LYS N . 53241 1 85 . 1 . 1 60 60 LYS H H 1 8.002 . . 1 . . . . . 60 LYS H . 53241 1 86 . 1 . 1 60 60 LYS N N 15 121.503 . . 1 . . . . . 60 LYS N . 53241 1 87 . 1 . 1 61 61 ARG H H 1 7.919 . . 1 . . . . . 61 ARG H . 53241 1 88 . 1 . 1 61 61 ARG N N 15 120.88 . . 1 . . . . . 61 ARG N . 53241 1 89 . 1 . 1 62 62 GLU H H 1 7.967 . . 1 . . . . . 62 GLU H . 53241 1 90 . 1 . 1 62 62 GLU N N 15 121.03 . . 1 . . . . . 62 GLU N . 53241 1 91 . 1 . 1 63 63 LEU H H 1 7.844 . . 1 . . . . . 63 LEU H . 53241 1 92 . 1 . 1 63 63 LEU N N 15 121.18 . . 1 . . . . . 63 LEU N . 53241 1 93 . 1 . 1 64 64 TYR H H 1 7.824 . . 1 . . . . . 64 TYR H . 53241 1 94 . 1 . 1 64 64 TYR N N 15 119.891 . . 1 . . . . . 64 TYR N . 53241 1 95 . 1 . 1 65 65 ASP H H 1 8.097 . . 1 . . . . . 65 ASP H . 53241 1 96 . 1 . 1 65 65 ASP N N 15 122.19 . . 1 . . . . . 65 ASP N . 53241 1 97 . 1 . 1 66 66 LYS H H 1 8.008 . . 1 . . . . . 66 LYS H . 53241 1 98 . 1 . 1 66 66 LYS N N 15 121.89 . . 1 . . . . . 66 LYS N . 53241 1 99 . 1 . 1 67 67 GLY H H 1 8.248 . . 1 . . . . . 67 GLY H . 53241 1 100 . 1 . 1 67 67 GLY N N 15 109.641 . . 1 . . . . . 67 GLY N . 53241 1 101 . 1 . 1 68 68 GLY H H 1 8.097 . . 1 . . . . . 68 GLY H . 53241 1 102 . 1 . 1 68 68 GLY N N 15 109.361 . . 1 . . . . . 68 GLY N . 53241 1 103 . 1 . 1 71 71 ALA H H 1 8.049 . . 1 . . . . . 71 ALA H . 53241 1 104 . 1 . 1 71 71 ALA N N 15 125.478 . . 1 . . . . . 71 ALA N . 53241 1 105 . 1 . 1 72 72 ILE H H 1 7.906 . . 1 . . . . . 72 ILE H . 53241 1 106 . 1 . 1 72 72 ILE N N 15 120.665 . . 1 . . . . . 72 ILE N . 53241 1 107 . 1 . 1 73 73 LYS H H 1 8.179 . . 1 . . . . . 73 LYS H . 53241 1 108 . 1 . 1 73 73 LYS N N 15 126.381 . . 1 . . . . . 73 LYS N . 53241 1 109 . 1 . 1 74 74 GLU H H 1 8.289 . . 1 . . . . . 74 GLU H . 53241 1 110 . 1 . 1 74 74 GLU N N 15 123.265 . . 1 . . . . . 74 GLU N . 53241 1 111 . 1 . 1 75 75 GLY H H 1 8.35 . . 1 . . . . . 75 GLY H . 53241 1 112 . 1 . 1 75 75 GLY N N 15 111.338 . . 1 . . . . . 75 GLY N . 53241 1 113 . 1 . 1 76 76 CYS H H 1 7.735 . . 1 . . . . . 76 CYS H . 53241 1 114 . 1 . 1 76 76 CYS N N 15 123.415 . . 1 . . . . . 76 CYS N . 53241 1 stop_ save_