Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f52af43a35f6f4a0b8c290ed4dc24cca",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 77.390,
"b": 90.067,
"c": 100.146,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.35,2.5],
"number_observations_unique": 24858,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.12
},
{
"type": "R(meas)",
"value": 0.13
},
{
"type": "R(pim)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 11.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.6,2.5],
"number_observations_unique": 2728,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.09
},
{
"type": "R(meas)",
"value": 1.18
},
{
"type": "R(pim)",
"value": 0.45
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.70
}
]
}
]
}