Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "31b2ac7025289a621fd3d29134d38b97",
"space_group_name": "P 31",
"unit_cell": {
"a": 58.949,
"b": 58.949,
"c": 53.026,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.010,2.410],
"number_observations_unique": 7999,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 11.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.500,2.410],
"number_observations_unique": 784,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.484
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 8.900
}
]
},
{
"resolution_limits": [2.600,2.500],
"number_observations_unique": 786,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.419
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.100
}
]
},
{
"resolution_limits": [2.710,2.600],
"number_observations_unique": 811,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.338
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.300
}
]
},
{
"resolution_limits": [2.860,2.710],
"number_observations_unique": 802,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.300
}
]
},
{
"resolution_limits": [3.040,2.860],
"number_observations_unique": 801,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.232
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.300
}
]
},
{
"resolution_limits": [3.270,3.040],
"number_observations_unique": 810,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.500
}
]
},
{
"resolution_limits": [3.600,3.270],
"number_observations_unique": 804,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.400
}
]
},
{
"resolution_limits": [4.120,3.600],
"number_observations_unique": 803,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.400
}
]
},
{
"resolution_limits": [5.190,4.120],
"number_observations_unique": 789,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.200
}
]
},
{
"resolution_limits": [50.000,5.190],
"number_observations_unique": 809,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 11.300
}
]
}
]
}