Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e56eb2310b0a6c8dd94ab6de540088ae",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 74.057,
"b": 133.648,
"c": 147.727,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.89842],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [147.73,2.19],
"number_observations_unique": 76235,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 12.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [147.73,10.95],
"number_observations_unique": 721,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 44.5
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 11.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.24,2.19],
"number_observations_unique": 4475,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.764
},
{
"type": "R(meas)",
"value": 1.901
},
{
"type": "R(pim)",
"value": 0.708
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 14
},
{
"type": "CC(1/2)",
"value": 0.612
}
]
}
]
}