Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7d9a10d9556c4159bcfa232f9ea385cb",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.466,
"b": 80.466,
"c": 139.654,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.930,1.440],
"number_observations": 940067,
"number_observations_unique": 49175,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 33.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.480,1.440],
"number_observations": 57152,
"number_observations_unique": 3492,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.726
},
{
"type": "R(meas)",
"value": 0.749
},
{
"type": "R(pim)",
"value": 0.183
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 16.400
},
{
"type": "CC(1/2)",
"value": 0.915
}
]
},
{
"resolution_limits": [27.930,6.430],
"number_observations": 11574,
"number_observations_unique": 676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 101.300
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 17.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}