Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1bc85d79c9cfc1d0498b5cf2eabbdf37",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.445,
"b": 42.445,
"c": 216.754,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.190,2.350],
"number_observations": 169439,
"number_observations_unique": 9125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.485
},
{
"type": "R(meas)",
"value": 0.498
},
{
"type": "R(pim)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 4.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.600
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.470,2.350],
"number_observations": 17585,
"number_observations_unique": 1274,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.048
},
{
"type": "R(meas)",
"value": 4.194
},
{
"type": "R(pim)",
"value": 1.057
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.800
},
{
"type": "CC(1/2)",
"value": 0.634
}
]
},
{
"resolution_limits": [54.190,7.420],
"number_observations": 6574,
"number_observations_unique": 378,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.206
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 17.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}