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added my sample 3pl1 json file with 4 muts to test the json validator

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Tanushree Tunstall 2022-11-11 18:27:03 +00:00
parent 9d9daf8e99
commit ebe09966c5
2 changed files with 115 additions and 0 deletions
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tt_3pl1_example.json Normal file
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{
"data_resource": "FoldX",
"resource_version": "5.0",
"software_version": "5.0",
"resource_entry_url": "http://foldxsuite.crg.eu/",
"pdb_id": "3PL1",
"chains": [
{
"residues": [
{
"pdb_res_label": "10",
"aa_type": "GLN",
"site_data": [
{
"site_id_ref": 1,
"confidence_score": 1,
"confidence_classification": "curated",
"raw_score": 3.9475,
"raw_score_unit": "kcal/mol",
"aa_variant": "GLY"
},
{
"site_id_ref": 2,
"confidence_score": 1,
"confidence_classification": "high",
"raw_score": 2.88633,
"raw_score_unit": "kcal/mol",
"aa_variant": "ALA"
}
]
},
{
"pdb_res_label": "11",
"aa_type": "ASN",
"site_data": [
{
"site_id_ref": 3,
"confidence_score": 1,
"confidence_classification": "curated",
"raw_score": 1.15843,
"raw_score_unit": "kcal/mol",
"aa_variant": "GLY"
}
]
},
{
"pdb_res_label": "12",
"aa_type": "ASP",
"site_data": [
{
"site_id_ref": 4,
"confidence_score": 1,
"confidence_classification": "high",
"raw_score": 1.71712,
"aa_variant": "GLY"
}
]
}
],
"chain_label": "A"
}
],
"sites": [
{
"site_id": 1,
"label": "ddG"
},
{
"site_id": 2,
"label": "ddG"
},
{
"site_id": 3,
"label": "ddG"
},
{
"site_id": 4,
"label": "ddG"
}
],
"evidence_code_ontology": [
{
"eco_term": "computational experiment",
"eco_code": "ECO_0000006"
}
]
}