Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2a677d7165ad415b1073f99c031d352f",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 86.102,
"b": 141.768,
"c": 42.496,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.28149,0.98397,1.28268],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.590,2.510],
"number_observations": 207845,
"number_observations_unique": 16179,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 21.800
},
{
"type": "Completeness",
"value": 87.100
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.650,2.510],
"number_observations": 11600,
"number_observations_unique": 1324,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.964
},
{
"type": "R(meas)",
"value": 1.025
},
{
"type": "R(pim)",
"value": 0.341
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 50.400
},
{
"type": "Redundancy",
"value": 8.800
},
{
"type": "CC(1/2)",
"value": 0.920
}
]
},
{
"resolution_limits": [73.590,7.940],
"number_observations": 8251,
"number_observations_unique": 683,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 55.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}