Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c58528d5411301da5a8b438c36ad3383",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.986,
"b": 52.546,
"c": 44.593,
"alpha": 90.00,
"beta": 103.15,
"gamma": 90.00
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.530,1.830],
"number_observations": 81404,
"number_observations_unique": 22402,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.235
},
{
"type": "R(meas)",
"value": 0.276
},
{
"type": "R(pim)",
"value": 0.142
},
{
"type": "I/SigI",
"value": 3.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [1.870,1.830],
"number_observations": 5169,
"number_observations_unique": 1382,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.703
},
{
"type": "R(meas)",
"value": 1.982
},
{
"type": "R(pim)",
"value": 1.000
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.300
}
]
},
{
"resolution_limits": [54.530,8.970],
"number_observations": 775,
"number_observations_unique": 207,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}