Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f542d17120d136c850a5e9b044e9d585",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 39.869,
"b": 70.546,
"c": 112.828,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [112.83,1.90],
"number_observations_unique": 12942,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.9
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [112.83,9.11],
"number_observations_unique": 150,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.94,1.90],
"number_observations_unique": 808,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.197
},
{
"type": "R(meas)",
"value": 1.394
},
{
"type": "R(pim)",
"value": 0.699
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.562
}
]
}
]
}