Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "23b5ff20c6732e4884fe096de559ff9f",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.899,
"b": 80.899,
"c": 139.985,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.010,1.550],
"number_observations": 775458,
"number_observations_unique": 40362,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 33.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.550],
"number_observations": 55644,
"number_observations_unique": 2916,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.793
},
{
"type": "R(meas)",
"value": 0.815
},
{
"type": "R(pim)",
"value": 0.184
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.931
}
]
},
{
"resolution_limits": [28.010,6.910],
"number_observations": 9556,
"number_observations_unique": 554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 107.600
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 17.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}