Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3961c8e90a7c47172ed4b07e2acef22e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.109,
"b": 70.989,
"c": 44.458,
"alpha": 90.00,
"beta": 118.26,
"gamma": 90.00
},
"wavelengths": [0.97242],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.09,1.54],
"number_observations": 79562,
"number_observations_unique": 30555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "R(meas)",
"value": 0.164
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 90.6
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.54],
"number_observations": 9300,
"number_observations_unique": 4208,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.108
},
{
"type": "R(meas)",
"value": 1.417
},
{
"type": "R(pim)",
"value": 0.870
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.582
}
]
}
]
}