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Datasets:
THU-ATOM
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posebusters

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sequences
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2 values
[ { "ligand": null, "proteinChain": { "count": 1, "msa": { "pairing_db": "uniref100", "precomputed_msa_dir": "msa/protenix/server/72792/0" }, "sequence": "NPSNSDAAHAFWSTQPVPQTEDETEKIVFAGPMDEPKTVADIPEEPYPIASTFEWWTPNMEAADDIHAIYELLRDNYVEDDDSMFRFNYSEEFLQWALCPPNYIPDWHVAVRRKADKKLLAFIAGVPVTLRMGTPKYMKVKAQEKGEGEEAAKYDEPRHICEINFLCVHKQLREKRLAPILIKEATRRVNRTNVWQAVYTAGVLLPTPYASGQYFHRSLNPEKLVEIRFSGIPAQYQKFQNPMAMLKRNYQLPSAPKNSGLREMKPSDVPQVRRILMNYLDSFDVGPVFSDAEISHYLLPRDGVVFTYVVENDKKVTDFFSFYRIPSTVIGNSNYNLLNAAYVHYYAATSIPLHQLILDLLIVAHSRGFDVCNMVEILDNRSFVEQLKFGAGDGHLRYYFYNWAYPKIKPSQVALVML" } }, { "ligand": { "count": 1, "ligand": "CCD_MYA" }, "proteinChain": null }, { "ligand": { "count": 1, "ligand": "CCD_MG" }, "proteinChain": null }, { "ligand": { "count": 1, "ligand": "CCD_NZB" }, "proteinChain": null } ]
[]
6tw7
[ { "ligand": null, "proteinChain": { "count": 1, "msa": { "pairing_db": "uniref100", "precomputed_msa_dir": "msa/protenix/server/61042/0" }, "sequence": "VTADAALEPDERAAWLAYNDTAEDFPGPHLLARLDAVAREHPDRPAVHAVDGVWTYRELHRRADAVAAFLAARGVRPGSVVAIAATRALAPYAALLGVLKAGCAYVPVNPDDPADRVAFVLADAGATPLLLDTDPASLPAAPAPDVPHEPDRVCYVIYTSGSTGRPKGVVMAERAVDNLTHWVVRRHDVRPDDRLGQTAPLTFDPSVQQVFPAWATGACLVTVPDDVQRDPAAFLDWLRAERVTHLDLVTSHWVHLLNAAEARPAELPDLRWIIIGGETYYYHQTHRWHRVVSSPARLNTIYGPTEAAVNATEHLTEPDLDHGQVPIGVPLPNYRLYALDDDGRLCPPGITGEIHIAGAGLARGYRSAEATAKAFHELEVHSGRTERLYRTGDLARLVRHADRWALEFQGRVDSQVKISGYRVELEEVDAAVKAVPGVRDAAVVVRGEPAEQLVCCYVGDVPPDRLRSRLTERLPAYLVPHLLVPVEALPFTRNGKMDTAELAELVRRFARDS" } }, { "ligand": { "count": 1, "ligand": "CCD_APC" }, "proteinChain": null } ]
[]
7xbv

Structure of posebusters.tar

  • precomputed_msa
    • id
      • pairing.a3m
      • non_pairing.a3m
  • ligands
    • xxx.sdf
  • proteins
    • xxx.pdb
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