Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "19eabcf87c64313edf8b744dc993e4b6",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 48.882,
"b": 48.882,
"c": 196.535,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.13,1.80],
"number_observations_unique": 26384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 16.5
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.7
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [49.13,9.00],
"number_observations_unique": 283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 54.1
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.9
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 1523,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.487
},
{
"type": "R(meas)",
"value": 1.631
},
{
"type": "R(pim)",
"value": 0.666
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.2
},
{
"type": "CC(1/2)",
"value": 0.666
}
]
}
]
}