Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "157e752eac6a5dc48b09e998efe88084",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.382,
"b": 59.834,
"c": 80.137,
"alpha": 79.36,
"beta": 81.67,
"gamma": 75.75
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.290,1.890],
"number_observations": 116615,
"number_observations_unique": 67122,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.890],
"number_observations": 8581,
"number_observations_unique": 4949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.557
},
{
"type": "R(meas)",
"value": 0.787
},
{
"type": "R(pim)",
"value": 0.557
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.297
}
]
},
{
"resolution_limits": [57.290,8.450],
"number_observations": 1489,
"number_observations_unique": 759,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 25.100
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}