Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9d172a0b967752be4c9b85b323211024",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.58,
"b": 46.03,
"c": 89.00,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.030,1.490],
"number_observations": 481527,
"number_observations_unique": 27966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 31.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 17.200
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.490],
"number_observations": 9524,
"number_observations_unique": 1968,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.487
},
{
"type": "R(pim)",
"value": 0.261
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
{
"resolution_limits": [46.030,6.660],
"number_observations": 11634,
"number_observations_unique": 378,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 111.900
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 30.800
}
]
}
]
}