Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "105ec70f8e42698a50782a7548f601d6",
"space_group_name": "P 1",
"unit_cell": {
"a": 36.602,
"b": 44.425,
"c": 116.574,
"alpha": 96.42,
"beta": 98.70,
"gamma": 103.36
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.720,2.700],
"number_observations": 34335,
"number_observations_unique": 18743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
},
"refln_shells": [
{
"resolution_limits": [2.830,2.700],
"number_observations_unique": 2528,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.464
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.649
}
]
}
]
}