Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3a33a9a008d9366870d3abf38cb0863a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 111.71,
"b": 114.26,
"c": 127.17,
"alpha": 90.00,
"beta": 93.14,
"gamma": 90.00
},
"wavelengths": [0.98009],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.760,2.9],
"number_observations_unique": 51644,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.182
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 72.9
},
{
"type": "Redundancy",
"value": 14
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.09,2.9],
"quality_factors": [
{
"type": "R(merge)",
"value": 2.48
},
{
"type": "R(meas)",
"value": 2.56
},
{
"type": "R(pim)",
"value": 0.94
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 21
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.51
}
]
}
]
}