Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "002ddfa2c7bf606fac51cf2a418639f1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 39.039,
"b": 49.634,
"c": 71.200,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97626],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.20,1.44],
"number_observations_unique": 25151,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 22.2
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [71.20,7.89],
"number_observations_unique": 200,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "Redundancy",
"value": 10.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.46,1.44],
"number_observations_unique": 1202,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.608
},
{
"type": "R(meas)",
"value": 1.737
},
{
"type": "R(pim)",
"value": 0.653
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.807
}
]
}
]
}