Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4fcd0d854df0c2271fd4af8ca762311d",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.750,
"b": 88.750,
"c": 39.474,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.370,0.940],
"number_observations": 1321812,
"number_observations_unique": 199198,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [0.960,0.940],
"number_observations": 44147,
"number_observations_unique": 9616,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.075
},
{
"type": "R(meas)",
"value": 2.345
},
{
"type": "R(pim)",
"value": 1.058
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.359
}
]
},
{
"resolution_limits": [44.370,5.150],
"number_observations": 8676,
"number_observations_unique": 1308,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 41.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}