data_HZP # _chem_comp.id HZP _chem_comp.name "(4S)-4-hydroxy-L-proline" _chem_comp.type "L-peptide linking" _chem_comp.pdbx_type ATOMP _chem_comp.formula "C5 H9 N O3" _chem_comp.mon_nstd_parent_comp_id PRO _chem_comp.pdbx_synonyms ? _chem_comp.pdbx_formal_charge 0 _chem_comp.pdbx_initial_date 2009-04-16 _chem_comp.pdbx_modified_date 2023-11-03 _chem_comp.pdbx_ambiguous_flag N _chem_comp.pdbx_release_status REL _chem_comp.pdbx_replaced_by ? _chem_comp.pdbx_replaces ? _chem_comp.formula_weight 131.130 _chem_comp.one_letter_code P _chem_comp.three_letter_code HZP _chem_comp.pdbx_model_coordinates_details ? _chem_comp.pdbx_model_coordinates_missing_flag N _chem_comp.pdbx_ideal_coordinates_details Corina _chem_comp.pdbx_ideal_coordinates_missing_flag N _chem_comp.pdbx_model_coordinates_db_code 3GXE _chem_comp.pdbx_subcomponent_list ? _chem_comp.pdbx_processing_site PDBJ # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.alt_atom_id _chem_comp_atom.type_symbol _chem_comp_atom.charge _chem_comp_atom.pdbx_align _chem_comp_atom.pdbx_aromatic_flag _chem_comp_atom.pdbx_leaving_atom_flag _chem_comp_atom.pdbx_stereo_config _chem_comp_atom.pdbx_backbone_atom_flag _chem_comp_atom.pdbx_n_terminal_atom_flag _chem_comp_atom.pdbx_c_terminal_atom_flag _chem_comp_atom.model_Cartn_x _chem_comp_atom.model_Cartn_y _chem_comp_atom.model_Cartn_z _chem_comp_atom.pdbx_model_Cartn_x_ideal _chem_comp_atom.pdbx_model_Cartn_y_ideal _chem_comp_atom.pdbx_model_Cartn_z_ideal _chem_comp_atom.pdbx_component_atom_id _chem_comp_atom.pdbx_component_comp_id _chem_comp_atom.pdbx_ordinal HZP OXT OXT O 0 1 N Y N Y N Y 25.271 -18.247 -18.170 2.728 0.851 -0.440 OXT HZP 1 HZP N N N 0 1 N N N Y Y N 25.299 -17.577 -14.636 -0.232 -1.341 -0.145 N HZP 2 HZP CA CA C 0 1 N N S Y N N 24.611 -17.749 -15.900 0.453 -0.098 -0.584 CA HZP 3 HZP C C C 0 1 N N N Y N Y 25.553 -17.543 -17.082 1.802 0.028 0.077 C HZP 4 HZP O O O 0 1 N N N Y N Y 26.516 -16.782 -17.002 2.049 -0.612 1.071 O HZP 5 HZP CB CB C 0 1 N N N N N N 23.532 -16.679 -15.924 -0.503 1.023 -0.102 CB HZP 6 HZP CG CG C 0 1 N N S N N N 23.445 -16.083 -14.534 -1.902 0.411 -0.343 CG HZP 7 HZP CD CD C 0 1 N N N N N N 24.569 -16.697 -13.703 -1.674 -1.112 -0.382 CD HZP 8 HZP OD1 OD1 O 0 1 N N N N N N 23.597 -14.685 -14.625 -2.784 0.752 0.729 OD1 HZP 9 HZP H HN H 0 1 N Y N Y Y N 25.401 -18.475 -14.208 0.098 -2.139 -0.667 HN HZP 10 HZP HA HA H 0 1 N N N Y N N 24.205 -18.767 -15.987 0.554 -0.077 -1.669 HA HZP 11 HZP HXT HXT H 0 1 N Y N Y N Y 25.917 -18.064 -18.842 3.578 0.898 0.019 HXT HZP 12 HZP HB HB H 0 1 N N N N N N 23.791 -15.898 -16.654 -0.350 1.231 0.957 HB HZP 13 HZP HBA HBA H 0 1 N N N N N N 22.565 -17.114 -16.217 -0.369 1.926 -0.697 HBA HZP 14 HZP HG HG H 0 1 N N N N N N 22.474 -16.295 -14.062 -2.308 0.757 -1.293 HG HZP 15 HZP HD HD H 0 1 N N N N N N 24.164 -17.271 -12.856 -1.956 -1.504 -1.359 HD HZP 16 HZP HDA HDA H 0 1 N N N N N N 25.224 -15.928 -13.266 -2.260 -1.595 0.399 HDA HZP 17 HZP HOD1 HOD1 H 0 0 N N N N N N 23.631 -14.312 -13.752 -3.677 0.395 0.632 HOD1 HZP 18 # loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.value_order _chem_comp_bond.pdbx_aromatic_flag _chem_comp_bond.pdbx_stereo_config _chem_comp_bond.pdbx_ordinal HZP OXT C SING N N 1 HZP CA N SING N N 2 HZP N CD SING N N 3 HZP N H SING N N 4 HZP C CA SING N N 5 HZP CB CA SING N N 6 HZP CA HA SING N N 7 HZP C O DOUB N N 8 HZP OXT HXT SING N N 9 HZP CB CG SING N N 10 HZP CB HB SING N N 11 HZP CB HBA SING N N 12 HZP OD1 CG SING N N 13 HZP CG CD SING N N 14 HZP CG HG SING N N 15 HZP CD HD SING N N 16 HZP CD HDA SING N N 17 HZP OD1 HOD1 SING N N 18 # loop_ _pdbx_chem_comp_descriptor.comp_id _pdbx_chem_comp_descriptor.type _pdbx_chem_comp_descriptor.program _pdbx_chem_comp_descriptor.program_version _pdbx_chem_comp_descriptor.descriptor HZP SMILES ACDLabs 10.04 "O=C(O)C1NCC(O)C1" HZP SMILES_CANONICAL CACTVS 3.341 "O[C@@H]1CN[C@@H](C1)C(O)=O" HZP SMILES CACTVS 3.341 "O[CH]1CN[CH](C1)C(O)=O" HZP SMILES_CANONICAL "OpenEye OEToolkits" 1.5.0 "C1[C@@H](CN[C@@H]1C(=O)O)O" HZP SMILES "OpenEye OEToolkits" 1.5.0 "C1C(CNC1C(=O)O)O" HZP InChI InChI 1.03 "InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4-/m0/s1" HZP InChIKey InChI 1.03 PMMYEEVYMWASQN-IMJSIDKUSA-N # loop_ _pdbx_chem_comp_identifier.comp_id _pdbx_chem_comp_identifier.type _pdbx_chem_comp_identifier.program _pdbx_chem_comp_identifier.program_version _pdbx_chem_comp_identifier.identifier HZP "SYSTEMATIC NAME" ACDLabs 10.04 "(4S)-4-hydroxy-L-proline" HZP "SYSTEMATIC NAME" "OpenEye OEToolkits" 1.5.0 "(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid" # loop_ _pdbx_chem_comp_audit.comp_id _pdbx_chem_comp_audit.action_type _pdbx_chem_comp_audit.date _pdbx_chem_comp_audit.processing_site HZP "Create component" 2009-04-16 PDBJ HZP "Modify descriptor" 2011-06-04 RCSB HZP "Modify backbone" 2023-11-03 PDBE #