Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4fa9f388c3ad8a0698bc99e42f681921",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.704,
"b": 51.388,
"c": 78.274,
"alpha": 90.00,
"beta": 93.13,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.290,1.589],
"number_observations_unique": 47965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "I/SigI",
"value": 10.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.670,1.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.810
},
{
"type": "Completeness",
"value": 92.300
},
{
"type": "Redundancy",
"value": 6.800
}
]
},
{
"resolution_limits": [44.290,9.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.700
}
]
}
]
}