Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "334cad0deed4603cffee9bed0a8bb7ba",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.203,
"b": 205.695,
"c": 72.569,
"alpha": 90.000,
"beta": 106.422,
"gamma": 90.000
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.85,1.84],
"number_observations_unique": 99914,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "R(meas)",
"value": 0.210
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.84],
"number_observations_unique": 4360,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.786
},
{
"type": "R(meas)",
"value": 6.354
},
{
"type": "R(pim)",
"value": 2.572
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Completeness",
"value": 87
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.094
}
]
}
]
}