Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "71bd006f3b09e11367adfe1bbf21bf59",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.343,
"b": 46.709,
"c": 87.794,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [87.790,1.900],
"number_observations": 87469,
"number_observations_unique": 13441,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 11.300
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 6.500
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.900],
"number_observations": 8127,
"number_observations_unique": 1706,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.734
},
{
"type": "R(pim)",
"value": 0.370
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 87.900
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
{
"resolution_limits": [87.790,6.010],
"number_observations": 2950,
"number_observations_unique": 508,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 26.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.800
}
]
}
]
}