Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cb0b24b71dddeae6f20c32f27a7df707",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 98.527,
"b": 98.526,
"c": 128.702,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.23,2.04],
"number_observations": 544256,
"number_observations_unique": 40033,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "R(meas)",
"value": 0.176
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 13.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.04],
"number_observations": 41878,
"number_observations_unique": 2964,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.571
},
{
"type": "R(meas)",
"value": 3.705
},
{
"type": "R(pim)",
"value": 0.982
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 14.1
},
{
"type": "CC(1/2)",
"value": 0.335
}
]
}
]
}