Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d6d789473ee2dd2ae32346cdf07b3aff",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 50.432,
"b": 70.809,
"c": 119.252,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.449,1.923],
"number_observations_unique": 22893,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 73.8
},
{
"type": "Redundancy",
"value": 4.4
}
]
},
"refln_shells": [
{
"resolution_limits": [2.103,1.923],
"number_observations": 3026,
"number_observations_unique": 614,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.373
},
{
"type": "R(meas)",
"value": 1.534
},
{
"type": "R(pim)",
"value": 0.669
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 4.9
}
]
}
]
}