Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a841ee449925cd14f204edef28411753",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.017,
"b": 126.942,
"c": 80.479,
"alpha": 90.00,
"beta": 105.66,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.100,2.860],
"number_observations": 90916,
"number_observations_unique": 21354,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.124
},
{
"type": "R(meas)",
"value": 0.169
},
{
"type": "R(pim)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [3.010,2.860],
"number_observations": 13017,
"number_observations_unique": 3088,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.579
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.773
}
]
},
{
"resolution_limits": [49.100,9.040],
"number_observations": 2696,
"number_observations_unique": 692,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 38.600
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}