Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce948de0cda84d3ec111d54a27d2f491",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.220,
"b": 81.979,
"c": 51.716,
"alpha": 90.000,
"beta": 114.634,
"gamma": 90.000
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.00,1.48],
"number_observations_unique": 60154,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 32.0
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.51,1.48],
"number_observations_unique": 2944,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.051
},
{
"type": "R(pim)",
"value": 0.716
},
{
"type": "I/SigI",
"value": 1.12
},
{
"type": "Completeness",
"value": 97.1
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.457
}
]
}
]
}