Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5a7be780f117f4ec89966d9c8a58a363",
"space_group_name": "P 1",
"unit_cell": {
"a": 38.10,
"b": 38.24,
"c": 147.79,
"alpha": 95.50,
"beta": 87.28,
"gamma": 101.85
},
"wavelengths": [1.12011],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [146.990,1.130],
"number_observations": 674897,
"number_observations_unique": 202752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 5.300
},
{
"type": "Completeness",
"value": 66.200
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.150,1.130],
"number_observations": 270,
"number_observations_unique": 158,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.293
},
{
"type": "R(meas)",
"value": 3.047
},
{
"type": "R(pim)",
"value": 1.981
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 1.000
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [146.990,6.170],
"number_observations": 6827,
"number_observations_unique": 1816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 32.800
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 3.800
}
]
}
]
}