Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f9f215340d32fd67e6971f363d6843b8",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 56.135,
"b": 62.774,
"c": 140.193,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.113,2.040],
"number_observations_unique": 30399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2
},
{
"type": "R(meas)",
"value": 0.385
},
{
"type": "R(pim)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 13.300
},
{
"type": "CC(1/2)",
"value": 0.932
}
]
},
"refln_shells": [
{
"resolution_limits": [2.089,2.040],
"number_observations_unique": 1522,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.9
},
{
"type": "R(meas)",
"value": 10.876
},
{
"type": "R(pim)",
"value": 2.986
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.590
}
]
},
{
"resolution_limits": [52.113,5.845],
"number_observations_unique": 1519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.901
}
]
}
]
}