Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "96222628b4403c70cad524ff13809dbc",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.707,
"b": 75.608,
"c": 88.123,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91991],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.57,1.65],
"number_observations_unique": 33544,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.13
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [75.57,7.38],
"number_observations_unique": 457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.05
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 21.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
{
"resolution_limits": [1.69,1.65],
"number_observations_unique": 2442,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.968
},
{
"type": "R(meas)",
"value": 2.04
},
{
"type": "R(pim)",
"value": 0.548
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.6
},
{
"type": "CC(1/2)",
"value": 0.792
}
]
}
]
}