Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a909ce9209f7ab778b0cdf13dd188ef",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 127.241,
"b": 127.241,
"c": 71.888,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.69,2.410],
"number_observations_unique": 26237,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.141
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.500,2.410],
"number_observations": 52634,
"number_observations_unique": 2695,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.681
},
{
"type": "R(meas)",
"value": 2.752
},
{
"type": "R(pim)",
"value": 0.615
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.707
}
]
},
{
"resolution_limits": [47.640,9.010],
"number_observations": 10770,
"number_observations_unique": 553,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 74.000
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}