Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0a47622c2ff78b669d7c48c2a6c2072c",
"space_group_name": "P 65",
"unit_cell": {
"a": 59.266,
"b": 59.266,
"c": 200.088,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.0500],
"number_observations_unique": 22657,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 14.800
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 4.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.140,2.070],
"number_observations_unique": 1779,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.562
},
{
"type": "Completeness",
"value": 72.800
},
{
"type": "Redundancy",
"value": 1.700
}
]
},
{
"resolution_limits": [2.230,2.140],
"number_observations_unique": 2039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.529
},
{
"type": "Completeness",
"value": 82.400
},
{
"type": "Redundancy",
"value": 2.100
}
]
},
{
"resolution_limits": [2.330,2.230],
"number_observations_unique": 2194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.536
},
{
"type": "Completeness",
"value": 89.900
},
{
"type": "Redundancy",
"value": 2.600
}
]
},
{
"resolution_limits": [2.450,2.330],
"number_observations_unique": 2273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.522
},
{
"type": "Completeness",
"value": 92.000
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [2.610,2.450],
"number_observations_unique": 2337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.483
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [2.810,2.610],
"number_observations_unique": 2346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.375
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 4.000
}
]
},
{
"resolution_limits": [3.090,2.810],
"number_observations_unique": 2370,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
{
"resolution_limits": [3.540,3.090],
"number_observations_unique": 2425,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 6.200
}
]
},
{
"resolution_limits": [4.460,3.540],
"number_observations_unique": 2436,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [50.000,4.460],
"number_observations_unique": 2458,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 8.600
}
]
}
]
}