Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bc85d24be920619b2c0dabd909e0f2c6",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.827,
"b": 49.692,
"c": 83.075,
"alpha": 74.69,
"beta": 74.58,
"gamma": 61.32
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.040,2.130],
"number_observations": 55827,
"number_observations_unique": 34379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 93.600
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.130],
"number_observations": 8252,
"number_observations_unique": 5099,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.283
},
{
"type": "R(pim)",
"value": 0.200
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.855
}
]
},
{
"resolution_limits": [79.040,6.720],
"number_observations": 1946,
"number_observations_unique": 1053,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 89.800
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}