Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bd8f5148e02f791a69934e5e695b43b0",
"space_group_name": "P 1",
"unit_cell": {
"a": 33.127,
"b": 42.590,
"c": 44.242,
"alpha": 62.08,
"beta": 76.38,
"gamma": 87.00
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.66,1.05],
"number_observations_unique": 85077,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 14.4
},
{
"type": "Completeness",
"value": 88.6
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.11,1.05],
"number_observations": 49819,
"number_observations_unique": 9337,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.257
},
{
"type": "R(meas)",
"value": 1.388
},
{
"type": "R(pim)",
"value": 0.573
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
}
]
}