Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "79f213521e6df3c4b5f771fceb52d33f",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.502,
"b": 63.411,
"c": 77.662,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97945],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.830,1.570],
"number_observations": 186470,
"number_observations_unique": 30216,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 42.900
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.600,1.570],
"number_observations": 3347,
"number_observations_unique": 1070,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 71.700
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
{
"resolution_limits": [38.830,8.600],
"number_observations": 1268,
"number_observations_unique": 230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.014
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 83.300
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}