Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80a2e9bd197207dbf42b20ca76b7a748",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 73.42,
"b": 75.34,
"c": 242.48,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.340,2.300],
"number_observations": 99493,
"number_observations_unique": 40915,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.203
},
{
"type": "R(pim)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 68.200
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.958
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.300],
"number_observations_unique": 6118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.721
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "Completeness",
"value": 70.500
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.313
}
]
},
{
"resolution_limits": [75.340,7.270],
"number_observations_unique": 1444,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "Completeness",
"value": 69.500
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
}
]
}