Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ade71cf8714f7f5a61980f1a3aeebfc1",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 142.971,
"b": 142.971,
"c": 75.135,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.720,2.600],
"number_observations": 1128236,
"number_observations_unique": 14420,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.196
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 29.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 78.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.720,2.600],
"number_observations_unique": 1708,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.9
},
{
"type": "R(meas)",
"value": 15.261
},
{
"type": "R(pim)",
"value": 1.682
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 81.300
},
{
"type": "CC(1/2)",
"value": 0.365
}
]
},
{
"resolution_limits": [39.720,9.010],
"number_observations_unique": 415,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.004
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 58.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}