Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "918b71f10797edb6dabe172b647e7d97",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.274,
"b": 88.274,
"c": 38.751,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.260,1.080],
"number_observations": 681890,
"number_observations_unique": 126536,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(meas)",
"value": 0.132
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 3.500
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.100,1.080],
"number_observations": 18987,
"number_observations_unique": 5763,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.418
},
{
"type": "R(meas)",
"value": 1.687
},
{
"type": "R(pim)",
"value": 0.900
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.358
}
]
},
{
"resolution_limits": [88.260,5.910],
"number_observations": 5872,
"number_observations_unique": 855,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 13.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}