Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3882cb2fb27e55aa87df0656d49fe270",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 66.670,
"b": 74.256,
"c": 79.653,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.31,2.16],
"number_observations": 276544,
"number_observations_unique": 21392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.144
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 10.2
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.16],
"number_observations": 37283,
"number_observations_unique": 3110,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.036
},
{
"type": "R(meas)",
"value": 2.130
},
{
"type": "R(pim)",
"value": 0.606
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 12.0
},
{
"type": "CC(1/2)",
"value": 0.618
}
]
}
]
}