Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9336a360104ccf0993899e42e7aaddd3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.294,
"b": 53.564,
"c": 44.498,
"alpha": 90.00,
"beta": 101.27,
"gamma": 90.00
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.04,1.49],
"number_observations": 122485,
"number_observations_unique": 42711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.49],
"number_observations": 4066,
"number_observations_unique": 1999,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.228
},
{
"type": "R(meas)",
"value": 1.598
},
{
"type": "R(pim)",
"value": 1.011
},
{
"type": "I/SigI",
"value": 0.1
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.309
}
]
}
]
}