Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6ba0fe8a23263b447d2df85afa6d4bd3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 217.558,
"b": 108.448,
"c": 63.093,
"alpha": 90.000,
"beta": 90.059,
"gamma": 90.000
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.53,2.338],
"number_observations_unique": 60351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.229
},
{
"type": "R(meas)",
"value": 0.255
},
{
"type": "R(pim)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 4.96
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.34],
"number_observations_unique": 3005,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.877
},
{
"type": "R(meas)",
"value": 0.978
},
{
"type": "R(pim)",
"value": 0.426
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 5
},
{
"type": "CC(1/2)",
"value": 0.335
}
]
}
]
}