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diff --git a/8r8k_H_L_A_sample_1_lddt_backbone.json b/8r8k_H_L_A_sample_1_lddt_backbone.json new file mode 100644 index 0000000000000000000000000000000000000000..1edd45a4c8947443a1a7face09620a90e58f170c --- /dev/null +++ b/8r8k_H_L_A_sample_1_lddt_backbone.json @@ -0,0 +1,50 @@ +{ + "entry": "8r8k_H_L_A_sample_1", + "success": true, + "error": null, + "lddt": { + "total": 0.9190129041671753, + "cdr": 0.8386616408824921, + "framework": 0.9335215389728546 + }, + "num_pred_atoms": 1788, + "num_gt_atoms": 940, + "num_aligned_atoms": 940, + "alignment_coverage": { + "pred_coverage": 0.5257270693512305, + "gt_coverage": 1.0, + "full_coverage": false + }, + "heavy_chain": { + "chain_id": "H", + "total": 0.9163074493408203, + "cdr": 0.7298714518547058, + "framework": 0.9517441391944885, + "cdr1": 0.942460298538208, + "cdr2": 0.9621976017951965, + "cdr3": 0.692307710647583, + "num_residues": 128, + "num_cdr_residues": 32 + }, + "light_chain": { + "chain_id": "L", + "total": 0.9217183589935303, 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newline at end of file diff --git a/8sic_A_B_E_sample_1_lddt_backbone.json b/8sic_A_B_E_sample_1_lddt_backbone.json new file mode 100644 index 0000000000000000000000000000000000000000..2390a952cd13cd41a5efaa8459c12658940327c5 --- /dev/null +++ b/8sic_A_B_E_sample_1_lddt_backbone.json @@ -0,0 +1,50 @@ +{ + "entry": "8sic_A_B_E_sample_1", + "success": true, + "error": null, + "lddt": { + "total": 0.9124888479709625, + "cdr": 0.8941004276275635, + "framework": 0.9136594235897064 + }, + "num_pred_atoms": 1748, + "num_gt_atoms": 1748, + "num_aligned_atoms": 1748, + "alignment_coverage": { + "pred_coverage": 1.0, + "gt_coverage": 1.0, + "full_coverage": true + }, + "heavy_chain": { + "chain_id": "A", + "total": 0.9050304889678955, + "cdr": 0.9286296963691711, + "framework": 0.8978682160377502, + "cdr1": 0.9474637508392334, + "cdr2": 0.9827898740768433, + "cdr3": 0.9620327353477478, + "num_residues": 222, + "num_cdr_residues": 25 + }, + "light_chain": { + "chain_id": "B", + "total": 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a/8to9_D_F_A_sample_1_lddt.json b/8to9_D_F_A_sample_1_lddt.json new file mode 100644 index 0000000000000000000000000000000000000000..4b182e9b4ece1c6b29ab17d2f012cb162a384999 --- /dev/null +++ b/8to9_D_F_A_sample_1_lddt.json @@ -0,0 +1,50 @@ +{ + "entry": "8to9_D_F_A_sample_1", + "success": true, + "error": null, + "lddt": { + "total": 0.7785387933254242, + "cdr": 0.8205552101135254, + "framework": 0.7696721255779266 + }, + "num_pred_atoms": 1731, + "num_gt_atoms": 1787, + "num_aligned_atoms": 1658, + "alignment_coverage": { + "pred_coverage": 0.9578278451761987, + "gt_coverage": 0.9278119753777281, + "full_coverage": false + }, + "heavy_chain": { + "chain_id": "D", + "total": 0.7730579972267151, + "cdr": 0.790944516658783, + "framework": 0.769234299659729, + "cdr1": 0.9193272590637207, + "cdr2": 0.884482741355896, + "cdr3": 0.8471866846084595, + "num_residues": 126, + "num_cdr_residues": 31 + }, + "light_chain": { + "chain_id": "F", + "total": 0.7840195894241333, + "cdr": 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a/8tqi_H_L_B_sample_4_lddt.json b/8tqi_H_L_B_sample_4_lddt.json new file mode 100644 index 0000000000000000000000000000000000000000..a20f9f53544ee80270700cbbe5cafe9c3dea3b34 --- /dev/null +++ b/8tqi_H_L_B_sample_4_lddt.json @@ -0,0 +1,50 @@ +{ + "entry": "8tqi_H_L_B_sample_4", + "success": true, + "error": null, + "lddt": { + "total": 0.8699825406074524, + "cdr": 0.8311201632022858, + "framework": 0.8776737451553345 + }, + "num_pred_atoms": 3244, + "num_gt_atoms": 1710, + "num_aligned_atoms": 1605, + "alignment_coverage": { + "pred_coverage": 0.49475955610357586, + "gt_coverage": 0.9385964912280702, + "full_coverage": false + }, + "heavy_chain": { + "chain_id": "H", + "total": 0.8585904836654663, + "cdr": 0.7425166368484497, + "framework": 0.8796873092651367, + "cdr1": 0.9128919839859009, + "cdr2": 0.9821428656578064, + "cdr3": 0.7178263664245605, + "num_residues": 120, + "num_cdr_residues": 24 + }, + "light_chain": { + "chain_id": "L", + "total": 0.8813745975494385, + "cdr": 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a/8zhg_H_L_C_sample_4_lddt.json b/8zhg_H_L_C_sample_4_lddt.json new file mode 100644 index 0000000000000000000000000000000000000000..abd0264297e936ede0ade712f59db18763065336 --- /dev/null +++ b/8zhg_H_L_C_sample_4_lddt.json @@ -0,0 +1,50 @@ +{ + "entry": "8zhg_H_L_C_sample_4", + "success": true, + "error": null, + "lddt": { + "total": 0.7565552294254303, + "cdr": 0.8008775413036346, + "framework": 0.7497506141662598 + }, + "num_pred_atoms": 1960, + "num_gt_atoms": 1746, + "num_aligned_atoms": 1622, + "alignment_coverage": { + "pred_coverage": 0.8275510204081633, + "gt_coverage": 0.9289805269186713, + "full_coverage": false + }, + "heavy_chain": { + "chain_id": "H", + "total": 0.7562942504882812, + "cdr": 0.7792986035346985, + "framework": 0.7527124285697937, + "cdr1": 0.8532282114028931, + "cdr2": 0.9682765007019043, + "cdr3": 0.8020704388618469, + "num_residues": 120, + "num_cdr_residues": 24 + }, + "light_chain": { + "chain_id": "L", + "total": 0.7568162083625793, + "cdr": 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