Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bf89ad46f721f9f08e01ecb0fec0483e",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 91.423,
"b": 91.423,
"c": 139.872,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.710,3.200],
"number_observations_unique": 6156,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 20.20
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 18.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [3.39,3.200],
"number_observations_unique": 948,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.457
},
{
"type": "R(meas)",
"value": 1.495
},
{
"type": "I/SigI",
"value": 2.13
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 19.400
},
{
"type": "CC(1/2)",
"value": 0.744
}
]
},
{
"resolution_limits": [3.62,3.39],
"number_observations_unique": 17743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.768
},
{
"type": "R(meas)",
"value": 0.789
},
{
"type": "I/SigI",
"value": 4.34
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 19.6
},
{
"type": "CC(1/2)",
"value": 0.909
}
]
}
]
}