Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1f473036ec96e8c296aae4046dc88114",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 43.674,
"b": 65.631,
"c": 84.355,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97908],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [84.355,1.15],
"number_observations_unique": 83049,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.157,1.15],
"number_observations_unique": 846,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.966
},
{
"type": "R(meas)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.465
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.631
}
]
},
{
"resolution_limits": [84.355,5.353],
"number_observations_unique": 964,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
}
]
}