Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "877c6090ee4a9445eb1f9a32a0fc57bd",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 137.631,
"b": 50.302,
"c": 34.008,
"alpha": 90.00,
"beta": 93.46,
"gamma": 90.00
},
"wavelengths": [0.87260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.100],
"number_observations_unique": 13264,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 8.800
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 6.200
}
]
},
"refln_shells": [
{
"resolution_limits": [2.140,2.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.255
},
{
"type": "Completeness",
"value": 83.600
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [2.180,2.140],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "Completeness",
"value": 88.700
},
{
"type": "Redundancy",
"value": 3.700
}
]
},
{
"resolution_limits": [2.220,2.180],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 4.100
}
]
},
{
"resolution_limits": [2.260,2.220],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.209
},
{
"type": "Completeness",
"value": 92.700
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
{
"resolution_limits": [2.310,2.260],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.210
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 4.700
}
]
},
{
"resolution_limits": [2.370,2.310],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
{
"resolution_limits": [2.420,2.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.190
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 5.300
}
]
},
{
"resolution_limits": [2.490,2.420],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.800
}
]
},
{
"resolution_limits": [2.560,2.490],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.000
}
]
},
{
"resolution_limits": [2.650,2.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.400
}
]
},
{
"resolution_limits": [2.740,2.650],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.700
}
]
},
{
"resolution_limits": [2.850,2.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 7.100
}
]
},
{
"resolution_limits": [2.980,2.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 7.500
}
]
},
{
"resolution_limits": [3.140,2.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 7.600
}
]
},
{
"resolution_limits": [3.330,3.140],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [3.590,3.330],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [3.950,3.590],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 7.700
}
]
},
{
"resolution_limits": [4.520,3.950],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.600
}
]
},
{
"resolution_limits": [5.700,4.520],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.600
}
]
},
{
"resolution_limits": [50.000,5.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.300
}
]
}
]
}