Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bcd7f286e0f864a2439c1145e6d2805e",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.602,
"b": 66.271,
"c": 125.283,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.520,2.250],
"number_observations": 301166,
"number_observations_unique": 15565,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.196
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.320,2.250],
"number_observations_unique": 1402,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.418
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 18.700
},
{
"type": "CC(1/2)",
"value": 0.920
}
]
},
{
"resolution_limits": [45.520,9.000],
"number_observations_unique": 304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 15.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}