Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "96933a72b09a0cb9add0c1b6370de243",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 58.728,
"b": 79.003,
"c": 160.185,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97775],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.880,2.07],
"number_observations_unique": 45653,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 14.290
},
{
"type": "Completeness",
"value": 97.600
}
]
},
"refln_shells": [
{
"resolution_limits": [2.14,2.07],
"number_observations": 12766,
"number_observations_unique": 8299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.311
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [2.23,2.14],
"number_observations": 14100,
"number_observations_unique": 9133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.238
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [2.33,2.23],
"number_observations": 13291,
"number_observations_unique": 8588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "I/SigI",
"value": 4.3
},
{
"type": "Completeness",
"value": 99.10
}
]
},
{
"resolution_limits": [2.45,2.33],
"number_observations": 13324,
"number_observations_unique": 8582,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 99.40
}
]
},
{
"resolution_limits": [2.61,2.45],
"number_observations": 14071,
"number_observations_unique": 9039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 99.00
}
]
},
{
"resolution_limits": [2.81,2.61],
"number_observations": 13508,
"number_observations_unique": 8628,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 98.70
}
]
},
{
"resolution_limits": [3.09,2.81],
"number_observations": 13436,
"number_observations_unique": 8526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 14.4
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [3.53,3.09],
"number_observations": 13452,
"number_observations_unique": 8436,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 22.7
},
{
"type": "Completeness",
"value": 97.30
}
]
},
{
"resolution_limits": [4.44,3.53],
"number_observations": 13642,
"number_observations_unique": 8385,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 34.7
},
{
"type": "Completeness",
"value": 95.20
}
]
},
{
"resolution_limits": [28.880,4.44],
"number_observations": 13756,
"number_observations_unique": 8127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 41.6
},
{
"type": "Completeness",
"value": 90.90
}
]
}
]
}