Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5898f61c68b07304334827e5d1e98680",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 67.56,
"b": 91.14,
"c": 99.01,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.650,2.140],
"number_observations": 219919,
"number_observations_unique": 17199,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 13.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.200,2.140],
"number_observations": 16389,
"number_observations_unique": 1238,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.472
},
{
"type": "R(meas)",
"value": 1.531
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.757
}
]
},
{
"resolution_limits": [29.650,9.570],
"number_observations": 1830,
"number_observations_unique": 215,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 33.500
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}