Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "428f5e1b81335ee46ee1194db94cec7d",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.812,
"b": 64.467,
"c": 76.422,
"alpha": 106.53,
"beta": 92.43,
"gamma": 97.51
},
"wavelengths": [0.95374],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.220,2.300],
"number_observations": 75049,
"number_observations_unique": 37380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations": 7532,
"number_observations_unique": 3668,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.639
},
{
"type": "R(meas)",
"value": 0.864
},
{
"type": "R(pim)",
"value": 0.578
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.540
}
]
},
{
"resolution_limits": [48.220,8.910],
"number_observations": 1346,
"number_observations_unique": 645,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 9.100
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}