Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "192dabcd7eeb7f402e25b6708de2d4fc",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 152.814,
"b": 152.814,
"c": 135.178,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [132.340,3.8660],
"number_observations_unique": 17428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.263
},
{
"type": "R(meas)",
"value": 0.270
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [4.080,3.870],
"number_observations": 50543,
"number_observations_unique": 2519,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.607
},
{
"type": "R(meas)",
"value": 1.649
},
{
"type": "R(pim)",
"value": 0.366
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.100
},
{
"type": "CC(1/2)",
"value": 0.751
}
]
},
{
"resolution_limits": [132.340,12.230],
"number_observations": 7546,
"number_observations_unique": 577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 28.000
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}