Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "0519d0f16a1d86daf347df6ecd7afff5",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 90.303,
"b": 94.928,
"c": 48.241,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.464,1.68],
"number_observations_unique": 39403,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 13.6
},
{
"type": "Completeness",
"value": 92.9
},
{
"type": "Redundancy",
"value": 13.99
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [47.464,5.019],
"number_observations_unique": 1970,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 30.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
{
"resolution_limits": [1.826,1.681],
"number_observations_unique": 1970,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.137
},
{
"type": "R(meas)",
"value": 3.242
},
{
"type": "R(pim)",
"value": 0.787
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 40.4
},
{
"type": "CC(1/2)",
"value": 0.445
}
]
}
]
}