Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f28e1f0a1f89892a1c099648fa635764",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 42.460,
"b": 50.066,
"c": 58.781,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.11,1.40],
"number_observations_unique": 24784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 4.8
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations_unique": 1135,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.332
},
{
"type": "R(meas)",
"value": 1.728
},
{
"type": "R(pim)",
"value": 1.090
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.494
}
]
},
{
"resolution_limits": [38.11,7.67],
"number_observations_unique": 195,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}