data_SASDF55_MAIN
#
_sas_result.id                            1380
_sas_result.SASBDB_code                   SASDF55
_sas_result.experimental_MW               124.000
_sas_result.experimental_MW_error         .
_sas_result.MW_standard                   90.000
_sas_result.MW_standard_error             15.000
_sas_result.MW_Porod                      95.000
_sas_result.MW_Porod_error                .
_sas_result.I0_from_PR                    5749.0000000000
_sas_result.I0_from_PR_error              .
_sas_result.I0_from_Guinier               5745.4800000000
_sas_result.I0_from_Guinier_error         16.4300000000
_sas_result.Rg_from_PR                    4.860
_sas_result.Rg_from_PR_error              .
_sas_result.Rg_from_Guinier               4.730
_sas_result.Rg_from_Guinier_error         0.120
_sas_result.D_max                         16.00
_sas_result.Porod_volume                  152.00
_sas_result.Porod_volume_error            .
_sas_result.estimated_volume              .
_sas_result.estimated_volume_error        .
_sas_result.estimated_volume_method       .
_sas_result.Guinier_point_min             9
_sas_result.Guinier_point_max             104
_sas_result.type_of_curve                 merged
_sas_result.standard                      .
_sas_result.Dmax_error                    .
_sas_result.comments                      .
#
_sas_scan.title                     "Leukocidin (LukGH) from Staphylococcus aureus in complex with a neutralizing antibody"
_sas_scan.detc_id                   4
_sas_scan.id                        1380
_sas_scan.measurement_date          2017-09-17
_sas_scan.storage_temperature       15.0
_sas_scan.cell_temperature          10.0
_sas_scan.exposure_time             0.045
_sas_scan.number_of_frames          20
_sas_scan.unit                      1/nm
_sas_scan.qmin                      0.0468
_sas_scan.qmax                      3.7737
_sas_scan.sample_id                 1341
_sas_scan.result_id                 1380
_sas_scan.beam_id                   6
#
_sas_beam.id                         6
_sas_beam.instrument_name            "PETRA III EMBL P12"
_sas_beam.instrument_city            Hamburg
_sas_beam.instrument_country         Germany
_sas_beam.shape                      .
_sas_beam.type_of_source             "X-ray synchrotron"
_sas_beam.radiation_wavelength       0.120000
_sas_beam.dist_spec_to_detc          3.10000
#
_sas_detc.id              4
_sas_detc.name            "Pilatus 2M"
_sas_detc.type            .
_sas_detc.pixsize_x       .
#
_sas_sample.id                           1341
_sas_sample.name                         "Leukocidin (LukGH) from Staphylococcus aureus in complex with a neutralizing antibody"
_sas_sample.ext_coefficient              .
_sas_sample.contrast                     .
_sas_sample.specific_vol                 .
_sas_sample.purity_method                .
_sas_sample.dry_vol                      .
_sas_sample.sample_MW                    .
_sas_sample.specimen_concentration       0.40-4.60
_sas_sample.concentration_method         .
loop_
_sas_sample.entity_id                    
1577
1578
1579
#
_sas_buffer.id                  825
_sas_buffer.name                "20 mM Hepes, 300 mM NaCl, 1 mM MgCl2"
_sas_buffer.concentration       .
_sas_buffer.unit                .
_sas_buffer.pK                  .
_sas_buffer.pH                  7.500
_sas_buffer.comment             .
_sas_buffer.composition         .
_sas_buffer.sample_id           1341
#
loop_
_entity.id                             
_entity.type                           
_entity.pdbx_description               
_entity.formula_weight                 
_entity.pdbx_number_of_molecules       
1577 protein "Leukocidin G"                35.573 1
1578 protein "Leukocidin H"                37.619 1
1579 protein "LukGH neutralizing antibody" 47.441 1
#
loop_
_entity_name_com.entity_id       
_entity_name_com.name            
1577 LukG
1578 LukH
1579 Fab 
#
loop_
_entity_poly.entity_id                      
_entity_poly.pdbx_seq_one_letter_code       
1577 
;KINSEIKQVSEKNLDGDTKMYTRTATTSDSQKNITQSLQFNFLTEPNYDKETVFIKAKGTIGSGLRILDPNGYWN
STLRWPGSYSVSIQNVDDNNNTNVTDFAPKNQDESREVKYTYGYKTGGDFSINRGGLTGNITKESNYSETISYQQ
PSYRTLLDQSTSHKGVGWKVEAHLINNMGHDHTRQLTNDSDNRTKSEIFSLTRNGNLWAKDNFTPKDKMPVTVSE
GFNPEFLAVMSHDKKDKGKSQFVVHYKRSMDEFKIDWNRHGFWGYWSGENHVDKKEEKLSALYEVDWKTHNVKFV
KVLNDNEKK
;

1578 
;NSAHKDSQDQNKKEHVDKSQQKDKRNVTNKDKNSTAPDDIGKNGKITKRTETVYDEKTNILQNLQFDFIDDPTYD
KNVLLVKKQGSIHSNLKFESHKEEKNSNWLKYPSEYHVDFQVKRNRKTEILDQLPKNKISTAKVDSTFSYSSGGK
FDSTKGIGRTSSNSYSKTISYNQQNYDTIASGKNNNWHVHWSVIANDLKYGGEVKNRNDELLFYRNTRIATVENP
ELSFASKYRYPALVRSGFNPEFLTYLSNEKSNEKTQFEVTYTRNQDILKNRPGIHYAPPILEKNKDGQRLIVTYE
VDWKNKTVKVVDKYSDDNKPYKEG
;

1579 
;ELQLQESGPGLVKPSETLSLTCTVSGGSISSGSYYWDWIRQPPGKGLEWIGNIYKSGSTYYNPSLKSRVTISVDT
SKNQFSLKLSSVTAADTAVYYCARERGMHYMDVWGKGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKD
YFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEPKSCDKT
HT
DIQMTQSPSSLSASVGDRVTITCRASQSINSYLNWYQQKPGKAPKLLIYAASSLQSGVPSRFSGSGSGTDFTLTI
SSLQPEDFATYYCQQQFDPPFTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKV
DNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRGEC
;

#
loop_
_entity_src_gen.entity_id                  
_entity_src_gen.gene_src_common_name       
1577 "Staphylococcus aureus"
1578 "Staphylococcus aureus"
1579 "Homo sapiens"         
#
loop_
_struct_ref.id              
_struct_ref.entity_id       
_struct_ref.db_name         
_struct_ref.db_code         
_struct_ref.details         
1 1577 UniProt P21224 http://www.uniprot.org/uniprot/P21224
2 1578 UniProt Q5HEH9 http://www.uniprot.org/uniprot/Q5HEH9