Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9f2fbb976104cae41255d719416d9d9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.636,
"b": 56.870,
"c": 64.873,
"alpha": 90.00,
"beta": 94.92,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.15,1.42],
"number_observations": 376127,
"number_observations_unique": 59365,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 17.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.44,1.42],
"number_observations": 12759,
"number_observations_unique": 2906,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.123
},
{
"type": "R(meas)",
"value": 1.307
},
{
"type": "R(pim)",
"value": 0.642
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.245
}
]
}
]
}