87 lines
2 KiB
JSON
87 lines
2 KiB
JSON
{
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"data_resource": "FoldX",
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"resource_version": "5.0",
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"software_version": "5.0",
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"resource_entry_url": "http://foldxsuite.crg.eu/",
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"pdb_id": "3PL1",
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"chains": [
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{
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"residues": [
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{
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"pdb_res_label": "10",
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"aa_type": "GLN",
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"site_data": [
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{
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"site_id_ref": 1,
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"confidence_score": 1,
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"confidence_classification": "curated",
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"raw_score": 3.9475,
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"raw_score_unit": "kcal/mol",
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"aa_variant": "GLY"
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},
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{
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"site_id_ref": 2,
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"confidence_score": 1,
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"confidence_classification": "high",
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"raw_score": 2.88633,
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"raw_score_unit": "kcal/mol",
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"aa_variant": "ALA"
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}
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]
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},
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{
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"pdb_res_label": "11",
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"aa_type": "ASN",
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"site_data": [
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{
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"site_id_ref": 3,
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"confidence_score": 1,
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"confidence_classification": "curated",
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"raw_score": 1.15843,
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"raw_score_unit": "kcal/mol",
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"aa_variant": "GLY"
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}
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]
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},
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{
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"pdb_res_label": "12",
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"aa_type": "ASP",
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"site_data": [
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{
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"site_id_ref": 4,
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"confidence_score": 1,
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"confidence_classification": "high",
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"raw_score": 1.71712,
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"aa_variant": "GLY"
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}
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]
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}
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],
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"chain_label": "A"
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}
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],
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"sites": [
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{
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"site_id": 1,
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"label": "ddG"
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},
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{
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"site_id": 2,
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"label": "ddG"
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},
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{
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"site_id": 3,
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"label": "ddG"
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},
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{
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"site_id": 4,
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"label": "ddG"
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}
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],
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"evidence_code_ontology": [
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{
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"eco_term": "computational experiment",
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"eco_code": "ECO_0000006"
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}
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]
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}
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