Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "decb90bd2e83532f04b56d70c9aabf34",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 99.113,
"b": 99.102,
"c": 128.478,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.47,1.91],
"number_observations": 678879,
"number_observations_unique": 49202,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.269
},
{
"type": "R(meas)",
"value": 0.280
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.96,1.91],
"number_observations": 46697,
"number_observations_unique": 3246,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.710
},
{
"type": "R(meas)",
"value": 4.880
},
{
"type": "R(pim)",
"value": 1.273
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 14.4
},
{
"type": "CC(1/2)",
"value": 0.337
}
]
}
]
}