NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | type |
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495828 |
2ksk   |
cing | 1-original | 5 | comment |
# loop_ _audit_author.pdbx_ordinal _audit_author.name 1 "'De-Paula," V.S.' 2 "'Razzera," G.' 3 "'Barreto-Bergter," E.' 4 "'Almeida," F.' 5 "'Valente," A.P.' # _citation.id primary _citation.journal_abbrev 'to be published' _citation.title ? _citation.year ? _citation.journal_volume ? _citation.page_first ? _citation.page_last ? # _data_extraction.software pdb_extract _data_extraction.extraction_date 'Wed Jan 6 8:04:49 2010' _data_extraction.version 3.005 _data_extraction.release_date 'June "11," 2008' _data_extraction.location http://sw-tools.rcsb.org/apps/PDB_EXTRACT/ # loop_ _database_2.database_id _database_2.database_code PDB UNNAMED RCSB UNNAMED # loop_ _database_PDB_remark.id _database_PDB_remark.text 210 ; REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : NULL REMARK 210 PH : NULL REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : NULL REMARK 210 SPECTROMETER FIELD STRENGTH : NULL REMARK 210 SPECTROMETER MODEL : NULL REMARK 210 SPECTROMETER MANUFACTURER : NULL REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : UNIO REMARK 210 METHOD USED : NULL REMARK 210 REMARK 210 "CONFORMERS," NUMBER CALCULATED : NULL REMARK 210 "CONFORMERS," NUMBER SUBMITTED : 21 REMARK 210 "CONFORMERS," SELECTION CRITERIA : NULL REMARK 210 REMARK 210 REMARK: ; 215 ; REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE "INCLUDED," BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. ; # _entity.id 1 _entity.pdbx_description 'Sugarcane defensin 5' # _entity_poly.entity_id 1 _entity_poly.pdbx_seq_one_letter_code RAAATLRWPGL ; _entity_poly.pdbx_strand_id A _entity_poly.type 'polypeptide(L)' _entity_poly.pdbx_target_identifier ? # _entity_src_gen.entity_id ? _entity_src_gen.pdbx_gene_src_scientific_name 'Saccharum officinarum' _entity_src_gen.pdbx_gene_src_gene ? _entity_src_gen.gene_src_strain ? _entity_src_gen.pdbx_host_org_scientific_name 'Escherichia coli' _entity_src_gen.pdbx_host_org_strain 'BL21(DE3)' _entity_src_gen.pdbx_host_org_vector_type plasmid _entity_src_gen.plasmid_name pET28a _entity_src_gen.gene_src_details ? # _entry.id UNNAMED # _exptl.entry_id UNNAMED _exptl.method NMR # _pdbx_SG_project.id 1 _pdbx_SG_project.project_name ? _pdbx_SG_project.full_name_of_center ? # loop_ _pdbx_contact_author.id _pdbx_contact_author.name_salutation _pdbx_contact_author.name_first _pdbx_contact_author.name_last _pdbx_contact_author.name_mi _pdbx_contact_author.role _pdbx_contact_author.organization_type _pdbx_contact_author.email _pdbx_contact_author.address_1 _pdbx_contact_author.city _pdbx_contact_author.state_province _pdbx_contact_author.postal_code _pdbx_contact_author.country _pdbx_contact_author.fax _pdbx_contact_author.phone 2 Ms. Viviane 'De Paula' ? investigator academic vpaula@cnrmn.bioqmed.ufrj.br 'Av. Carlos Chagas "Filho," "373," "CCS," Bloco "K," Anexo CNRMN' 'Rio de Janeiro' 'Rio de Janeiro' 21941-902 Brasil -8002 -9045 3 Prof. 'Fabio C.L.' Almeida ? 'principal investigator' academic falmeida@cnrmn.bioqmed.ufrj.br 'Av. Carlos Chagas "Filho," "373," "CCS," Bloco "K," Anexo CNRMN' 'Rio de Janeiro' 'Rio de Janeiro' 21941-902 Brasil -8002 -9045 # _pdbx_database_status.entry_id UNNAMED _pdbx_database_status.status_code . _pdbx_database_status.dep_release_code_coordinates 'HOLD FOR RELEASE' _pdbx_database_status.dep_release_code_nmr_constraints ? _pdbx_database_status.dep_release_code_sequence ? # _pdbx_nmr_ensemble.entry_id UNNAMED _pdbx_nmr_ensemble.conformers_calculated_total_number 100 _pdbx_nmr_ensemble.conformers_submitted_total_number 20 _pdbx_nmr_ensemble.conformer_selection_criteria 'NULL MR STUDY' _pdbx_nmr_ensemble.average_constraints_per_residue ? _pdbx_nmr_ensemble.average_constraint_violations_per_residue ? _pdbx_nmr_ensemble.maximum_distance_constraint_violation ? _pdbx_nmr_ensemble.average_distance_constraint_violation ? _pdbx_nmr_ensemble.maximum_upper_distance_constraint_violation ? _pdbx_nmr_ensemble.maximum_lower_distance_constraint_violation ? _pdbx_nmr_ensemble.distance_constraint_violation_method ? _pdbx_nmr_ensemble.maximum_torsion_angle_constraint_violation ? _pdbx_nmr_ensemble.average_torsion_angle_constraint_violation ? _pdbx_nmr_ensemble.torsion_angle_constraint_violation_method ? # _pdbx_nmr_exptl.experiment_id 1 _pdbx_nmr_exptl.solution_id 1 _pdbx_nmr_exptl.conditions_id 1 _pdbx_nmr_exptl.type NULL # _pdbx_nmr_exptl_sample_conditions.conditions_id 1 _pdbx_nmr_exptl_sample_conditions.temperature NULL _pdbx_nmr_exptl_sample_conditions.pressure ? _pdbx_nmr_exptl_sample_conditions.pH 'NULL CONDUCTED : NULL' _pdbx_nmr_exptl_sample_conditions.ionic_strength ? _pdbx_nmr_exptl_sample_conditions.pressure_units ? # _pdbx_nmr_refine.entry_id UNNAMED _pdbx_nmr_refine.method 'simulated annealing' _pdbx_nmr_refine.details ? # _pdbx_nmr_representative.entry_id UNNAMED _pdbx_nmr_representative.conformer_id 1 _pdbx_nmr_representative.selection_criteria 'lowest energy' # _pdbx_nmr_sample_details.solution_id 1 _pdbx_nmr_sample_details.contents '5mM phosphate buffer; 90% "H2O," 10% D2O' _pdbx_nmr_sample_details.solvent_system '90% "H2O," 10% D2O' # _pdbx_nmr_software.name CYANA _pdbx_nmr_software.version ? _pdbx_nmr_software.classification refinement _pdbx_nmr_software.authors 'G??ntert P.' # _pdbx_nmr_spectrometer.spectrometer_id 1 _pdbx_nmr_spectrometer.type ? _pdbx_nmr_spectrometer.manufacturer 'NULL INATION.' _pdbx_nmr_spectrometer.model NULL _pdbx_nmr_spectrometer.field_strength NULL # _struct.entry_id UNNAMED _struct.title 'Solution Structure of Sugarcane defensin 5' _struct.pdbx_model_details ? # _struct_keywords.entry_id UNNAMED _struct_keywords.text 'CSalphabeta motif' #
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