Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c58ef85dc6e3c9d9b3b08224ec8e14fd",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.714,
"b": 88.714,
"c": 39.619,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.360,1.010],
"number_observations": 1023850,
"number_observations_unique": 161294,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 40753,
"number_observations_unique": 7880,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.992
},
{
"type": "R(meas)",
"value": 1.105
},
{
"type": "R(pim)",
"value": 0.472
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.711
}
]
},
{
"resolution_limits": [44.360,5.530],
"number_observations": 7267,
"number_observations_unique": 1071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 26.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}