Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d1148373c5ddda97c3c037327abdc64a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.309,
"b": 98.328,
"c": 58.795,
"alpha": 90.00,
"beta": 108.15,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.160,1.750],
"number_observations": 201886,
"number_observations_unique": 59451,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.780,1.750],
"number_observations": 11293,
"number_observations_unique": 3306,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.669
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.808
}
]
},
{
"resolution_limits": [49.160,9.090],
"number_observations": 1494,
"number_observations_unique": 446,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 26.600
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}