Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e3bf857dc93a928713ca2d461b02d4c2",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 114.721,
"b": 125.791,
"c": 125.930,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.550,2.900],
"number_observations": 271627,
"number_observations_unique": 40910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.020,2.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.467
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.400
}
]
},
{
"resolution_limits": [50.450,10.460],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.800
}
]
}
]
}