Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3308a0a0c3fecb745b47cb563bb9b2fa",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.836,
"b": 88.836,
"c": 39.373,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.420,0.990],
"number_observations": 1082366,
"number_observations_unique": 170631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 33632,
"number_observations_unique": 8294,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.365
},
{
"type": "R(meas)",
"value": 2.718
},
{
"type": "R(pim)",
"value": 1.302
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.295
}
]
},
{
"resolution_limits": [44.420,5.420],
"number_observations": 7602,
"number_observations_unique": 1129,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}