Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c1ef37ecd76ab8a397b680151f9fa144",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 228.639,
"b": 112.821,
"c": 221.328,
"alpha": 90.0,
"beta": 118.7,
"gamma": 90.0
},
"wavelengths": [0.97901,0.97916,0.97670],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.170,2.390],
"number_observations": 663454,
"number_observations_unique": 191535,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.430,2.390],
"number_observations_unique": 8492,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.703
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 88.400
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.621
}
]
}
]
}