Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "063cd0354f6bbd8be7984fa3a7c5a0cc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 35.949,
"b": 73.910,
"c": 55.495,
"alpha": 90.00,
"beta": 95.06,
"gamma": 90.00
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.28,1.55],
"number_observations": 249168,
"number_observations_unique": 38648,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 92.1
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.58,1.55],
"number_observations": 12629,
"number_observations_unique": 2069,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.957
},
{
"type": "R(meas)",
"value": 1.048
},
{
"type": "R(pim)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.675
}
]
}
]
}