Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c2a75b0d1bbdcfc36451e743f64d6a93",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.730,
"b": 180.678,
"c": 88.011,
"alpha": 90.00,
"beta": 106.26,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.46,2.30],
"number_observations_unique": 136358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.124
},
{
"type": "R(meas)",
"value": 0.145
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
"refln_shells": [
{
"resolution_limits": [2.35,2.30],
"number_observations": 18208,
"number_observations_unique": 4548,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.057
},
{
"type": "R(meas)",
"value": 1.220
},
{
"type": "R(pim)",
"value": 0.602
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.584
}
]
}
]
}