Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "89df4adc08d44ad3199f34de458e9b90",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 49.807,
"b": 106.232,
"c": 58.215,
"alpha": 90.00,
"beta": 109.23,
"gamma": 90.00
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [106.23,1.65],
"number_observations": 289398,
"number_observations_unique": 68325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.65],
"number_observations": 21944,
"number_observations_unique": 5035,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.093
},
{
"type": "R(meas)",
"value": 1.243
},
{
"type": "R(pim)",
"value": 0.585
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.476
}
]
}
]
}