Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e86fa7b229cd8fe87ae42b2b3ef91bc1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.779,
"b": 61.165,
"c": 32.377,
"alpha": 90.00,
"beta": 92.74,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.00,1.60],
"number_observations": 129596,
"number_observations_unique": 18388,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "R(meas)",
"value": 0.182
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 6.8
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations": 6604,
"number_observations_unique": 917,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.103
},
{
"type": "R(meas)",
"value": 2.265
},
{
"type": "R(pim)",
"value": 0.837
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.356
}
]
}
]
}