Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fe0bf6e4a5fc0bc115c2e2018e4768e0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.648,
"b": 101.186,
"c": 102.165,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.35500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [101.190,2.200],
"number_observations": 209612,
"number_observations_unique": 35165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(meas)",
"value": 0.159
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 12129,
"number_observations_unique": 2036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.949
},
{
"type": "R(meas)",
"value": 1.040
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 65.400
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.714
}
]
},
{
"resolution_limits": [101.190,9.070],
"number_observations": 3335,
"number_observations_unique": 602,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}