Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f58588cb0c3b96f1de65771dff8cc7fd",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 119.016,
"b": 179.591,
"c": 232.891,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.41,2.91],
"number_observations": 243688,
"number_observations_unique": 54540,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.154
},
{
"type": "R(meas)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 5.6
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.99,2.91],
"number_observations": 17323,
"number_observations_unique": 3964,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.667
},
{
"type": "R(meas)",
"value": 3.027
},
{
"type": "R(pim)",
"value": 1.401
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.147
}
]
}
]
}