Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aabe4124a895125275238b5b805077b2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.103,
"b": 98.855,
"c": 59.421,
"alpha": 90.00,
"beta": 107.91,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.080,1.500],
"number_observations": 336406,
"number_observations_unique": 96612,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 15262,
"number_observations_unique": 4761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.675
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.573
}
]
},
{
"resolution_limits": [49.080,8.220],
"number_observations": 2197,
"number_observations_unique": 623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}