Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "31f00fe1e1450da98d0424aeedd84d2e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.797,
"b": 47.869,
"c": 61.981,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.27,1.50],
"number_observations_unique": 34142,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "R(meas)",
"value": 0.247
},
{
"type": "R(pim)",
"value": 0.173
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 96.1
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [32.27,8.22],
"number_observations_unique": 237,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 1668,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.727
},
{
"type": "R(meas)",
"value": 2.430
},
{
"type": "R(pim)",
"value": 1.708
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.233
}
]
}
]
}