Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "92dc06d6f1e1f3743382cced5a12d01a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.770,
"b": 62.510,
"c": 147.154,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.59,1.30],
"number_observations": 1062370,
"number_observations_unique": 90638,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 92.7
},
{
"type": "Redundancy",
"value": 11.7
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.30],
"number_observations": 16345,
"number_observations_unique": 2501,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.595
},
{
"type": "R(meas)",
"value": 3.873
},
{
"type": "R(pim)",
"value": 1.408
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.194
}
]
}
]
}