Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "8d72da98a8bf683112464e57cd80d5f1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.870,
"b": 64.896,
"c": 73.657,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.69,1.56],
"number_observations": 144296,
"number_observations_unique": 23853,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 14.4
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.59,1.56],
"number_observations": 3076,
"number_observations_unique": 767,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.279
},
{
"type": "R(meas)",
"value": 1.462
},
{
"type": "R(pim)",
"value": 0.684
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.375
}
]
}
]
}