{
  "analysis_sha256": "1b295583d91748c5aa68c4cd15e7bcb72e635672b8dae983b08305bd706b459c",
  "coordinate_sha256": "19cc02095a47982e0b018b8bb3fd43ce3bd3cf8ce19217da4b84c974ef7ba409",
  "derived_csv_sha256": {
    "atom_contacts.csv": "0536a2d243f92e5404d9f4299515202dee1f4171cb31c994a70b5f8af25540b4",
    "residue_contacts.csv": "3236e0295c475b1241bde5d244554c01b75c2c2d8a71308944ea2e203013eb9f",
    "sensitivity.csv": "a5b283a5b52f55ba9acbc6066dd47d6c85d70804ffffa33269a12cac65e344e2"
  },
  "frozen_reference_counts_after_independent_calculation": {
    "atom_pairs": 261,
    "residue_pairs": 49
  },
  "identity_assembly_and_sequences": "passed; model 1, label/auth A and B, biological assembly 1 identity operation",
  "inclusive_boundary": [
    {
      "case": "below",
      "distance_angstrom": 4.499999999999999,
      "expected_included": true,
      "observed_included": true,
      "passed": true
    },
    {
      "case": "at",
      "distance_angstrom": 4.5,
      "expected_included": true,
      "observed_included": true,
      "passed": true
    },
    {
      "case": "above",
      "distance_angstrom": 4.500000000000001,
      "expected_included": false,
      "observed_included": false,
      "passed": true
    }
  ],
  "independent_cross_checks": [
    {
      "cutoff_angstrom": 3.0,
      "maximum_distance_difference_angstrom": 4.440892098500626e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 3.25,
      "maximum_distance_difference_angstrom": 4.440892098500626e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 3.5,
      "maximum_distance_difference_angstrom": 4.440892098500626e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 3.75,
      "maximum_distance_difference_angstrom": 4.440892098500626e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 4.0,
      "maximum_distance_difference_angstrom": 4.440892098500626e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 4.25,
      "maximum_distance_difference_angstrom": 8.881784197001252e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 4.5,
      "maximum_distance_difference_angstrom": 8.881784197001252e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 4.75,
      "maximum_distance_difference_angstrom": 8.881784197001252e-16,
      "passed": true
    },
    {
      "cutoff_angstrom": 5.0,
      "maximum_distance_difference_angstrom": 8.881784197001252e-16,
      "passed": true
    }
  ],
  "independent_method": "Raw CIF atom category, all A/B non-H/D pairs, math.dist; separate from ExoMBridge parser and primary cell-list squared-distance method.",
  "method": {
    "analysis_script_sha256": "fe240a12478911c4eac97679db31f038dba7d8e76004ec25f11332d49b385bf9",
    "exombridge_analysis_geometry_sha256": "ca78d6aaf2717470ac65f8af058d3201e8fa08f58dc9c70d1cf62e9fe957bafd",
    "exombridge_geometry_method": "molecular-analysis-v1",
    "gemmi": "0.6.5",
    "python": "3.12.3",
    "reference_figure_method": "8t5e-reference-proximity-v1"
  },
  "passed": true,
  "rigid_transform": {
    "maximum_distance_difference_angstrom": 2.6645352591003757e-15,
    "passed": true,
    "rotation": [
      [
        0,
        -1,
        0
      ],
      [
        1,
        0,
        0
      ],
      [
        0,
        0,
        1
      ]
    ],
    "translation_angstrom": [
      11.25,
      -9.75,
      3.125
    ]
  },
  "schema_version": 1,
  "scope": "Deterministic coordinate geometry checks, not experimental replication, affinity estimation, or validation of a prediction.",
  "source_file_integrity": {
    "8T5E.cif": {
      "bytes": 199626,
      "sha256": "19cc02095a47982e0b018b8bb3fd43ce3bd3cf8ce19217da4b84c974ef7ba409"
    },
    "assembly-1.json": {
      "bytes": 2949,
      "sha256": "6bcab6c15b1ddff248d7688c2b66275ce24e2553c9b459105d14b9c5389bbaeb"
    },
    "entity-1.json": {
      "bytes": 8966,
      "sha256": "4cf5077c32e9c568f66449f752858791a711915a5fd70691f57cefa269d465ee"
    },
    "entity-2.json": {
      "bytes": 34693,
      "sha256": "5a060a9f5a7e7ed54133aca76b4540fedab25dbaac9883229fc8ec8ee6c3c148"
    },
    "entry.json": {
      "bytes": 12025,
      "sha256": "5c027b36f21d70d38f1792d9b8cae0fa74ce5bcb7f26e7147c195eff32358d24"
    }
  }
}